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]-N-pyridin-3-yl-benzamide

Systemtic Name: 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]-N-pyridin-3-yl-benzamide Openeye Name: 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]-N-(3-pyridyl)benzamide CAS Name: 4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[(2-methyl-8-quinolinyl)oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-(3-pyridinyl)benzamide IUPAC Name: 4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[(2-methylquinolin-8-yl)oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-pyridin-3-ylbenzamide Traditional Name: 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]-N-(3-pyridyl)benzamide Formula: C35H29Cl2N5O4 MolecularWeight: 654.54186

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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)C(=O)NC5=CN=CC=C5)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)C(=O)NC5=CN=CC=C5)Cl)C=C1

InChI

InChI=1S/C35H29Cl2N5O4/c1-22-8-12-24-5-3-7-30(34(24)40-22)46-21-27-28(36)15-16-29(33(27)37)42(2)32(44)20-39-31(43)17-11-23-9-13-25(14-10-23)35(45)41-26-6-4-18-38-19-26/h3-19H,20-21H2,1-2H3,(H,39,43)(H,41,45)/b17-11+