diethyl 2-[[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]carbonylamino]pentanedioate

Systemtic Name: diethyl 2-[[4-[(3-methyl-1-oxidanylidene-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]carbonylamino]pentanedioate Openeye Name: diethyl 2-[[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]benzoyl]amino]pentanedioate CAS Name: 2-[[[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]phenyl]-oxomethyl]amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-[(3-methyl-1-oxo-4H-benzo[f]quinazolin-9-yl)methylamino]benzoyl]amino]pentanedioate Traditional Name: 2-[[4-[(1-keto-3-methyl-4H-benzo[f]quinazolin-9-yl)methylamino]benzoyl]amino]glutaric acid diethyl ester Formula: C30H32N4O6 MolecularWeight: 544.59828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)C=CC4=C3C(=O)N=C(N4)C

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC(=O)C1=CC=C(C=C1)NCC2=CC3=C(C=C2)C=CC4=C3C(=O)N=C(N4)C

InChI

InChI=1S/C30H32N4O6/c1-4-39-26(35)15-14-25(30(38)40-5-2)34-28(36)21-8-11-22(12-9-21)31-17-19-6-7-20-10-13-24-27(23(20)16-19)29(37)33-18(3)32-24/h6-13,16,25,31H,4-5,14-15,17H2,1-3H3,(H,34,36)(H,32,33,37)