[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 3-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 3-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 3-(3-cyclopropyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-cyclopropyl-4-oxo-2-quinazolinyl)propanoic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 3-(3-cyclopropyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(3-cyclopropyl-4-keto-quinazolin-2-yl)propionic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C27H30N4O4 MolecularWeight: 474.5515

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)CCC3=NC4=CC=CC=C4C(=O)N3C5CC5

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)CCC3=NC4=CC=CC=C4C(=O)N3C5CC5

InChI

InChI=1S/C27H30N4O4/c32-25(28-19-8-10-20(11-9-19)30-16-4-1-5-17-30)18-35-26(33)15-14-24-29-23-7-3-2-6-22(23)27(34)31(24)21-12-13-21/h2-3,6-11,21H,1,4-5,12-18H2,(H,28,32)