propan-2-yl 3-[4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanoylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)butanoylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[4-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)butanoylamino]-3-phenyl-propanoate CAS Name: 3-[[4-(6,7-dimethoxy-4-oxo-3-quinazolinyl)-1-oxobutyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)butanoylamino]-3-phenylpropanoate Traditional Name: 3-[4-(4-keto-6,7-dimethoxy-quinazolin-3-yl)butanoylamino]-3-phenyl-propionic acid isopropyl ester Formula: C26H31N3O6 MolecularWeight: 481.54084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

InChI

InChI=1S/C26H31N3O6/c1-17(2)35-25(31)15-20(18-9-6-5-7-10-18)28-24(30)11-8-12-29-16-27-21-14-23(34-4)22(33-3)13-19(21)26(29)32/h5-7,9-10,13-14,16-17,20H,8,11-12,15H2,1-4H3,(H,28,30)