tert-butyl 4-[2-[2-[(3-ethoxy-3-oxidanylidene-propyl)amino]-2-oxidanylidene-ethyl]-1-oxidanylidene-3,4-dihydroisoquinolin-7-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[2-[(3-ethoxy-3-oxidanylidene-propyl)amino]-2-oxidanylidene-ethyl]-1-oxidanylidene-3,4-dihydroisoquinolin-7-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[2-[(3-ethoxy-3-oxo-propyl)amino]-2-oxo-ethyl]-1-oxo-3,4-dihydroisoquinolin-7-yl]piperazine-1-carboxylate CAS Name: 4-[2-[2-[(3-ethoxy-3-oxopropyl)amino]-2-oxoethyl]-1-oxo-3,4-dihydroisoquinolin-7-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[2-[(3-ethoxy-3-oxopropyl)amino]-2-oxoethyl]-1-oxo-3,4-dihydroisoquinolin-7-yl]piperazine-1-carboxylate Traditional Name: 4-[2-[2-[(3-ethoxy-3-keto-propyl)amino]-2-keto-ethyl]-1-keto-3,4-dihydroisoquinolin-7-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H36N4O6 MolecularWeight: 488.57654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)CN1CCC2=C(C1=O)C=C(C=C2)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CCNC(=O)CN1CCC2=C(C1=O)C=C(C=C2)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H36N4O6/c1-5-34-22(31)8-10-26-21(30)17-29-11-9-18-6-7-19(16-20(18)23(29)32)27-12-14-28(15-13-27)24(33)35-25(2,3)4/h6-7,16H,5,8-15,17H2,1-4H3,(H,26,30)