tert-butyl 2-[[4-[(E)-3-[[2-[[2,4-bis(chloranyl)-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-oxidanylidene-prop-1-enyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[4-[(E)-3-[[2-[[2,4-bis(chloranyl)-3-[(2-methylquinolin-8-yl)oxymethyl]phenyl]-methyl-amino]-2-oxidanylidene-ethyl]amino]-3-oxidanylidene-prop-1-enyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[(2-methyl-8-quinolyl)oxymethyl]anilino]-2-oxo-ethyl]amino]-3-oxo-prop-1-enyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[(2-methyl-8-quinolinyl)oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]anilino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[(2-methylquinolin-8-yl)oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[(2-methyl-8-quinolyl)oxymethyl]anilino]-2-keto-ethyl]amino]-3-keto-prop-1-enyl]phenyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C39H41Cl2N5O6 MolecularWeight: 746.67874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)N(C)C(=O)CNC(=O)C=CC4=CC=C(C=C4)NC(=O)C5CCCN5C(=O)OC(C)(C)C)Cl)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OCC3=C(C=CC(=C3Cl)N(C)C(=O)CNC(=O)/C=C/C4=CC=C(C=C4)NC(=O)C5CCCN5C(=O)OC(C)(C)C)Cl)C=C1

InChI

InChI=1S/C39H41Cl2N5O6/c1-24-11-15-26-8-6-10-32(36(26)43-24)51-23-28-29(40)18-19-30(35(28)41)45(5)34(48)22-42-33(47)20-14-25-12-16-27(17-13-25)44-37(49)31-9-7-21-46(31)38(50)52-39(2,3)4/h6,8,10-20,31H,7,9,21-23H2,1-5H3,(H,42,47)(H,44,49)/b20-14+