methyl 4-[[(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[oxo-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-6-yl)methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

InChI

InChI=1S/C21H19N3O4/c1-28-21(27)14-6-4-13(5-7-14)12-22-19(25)15-8-9-16-17(11-15)23-18-3-2-10-24(18)20(16)26/h4-9,11H,2-3,10,12H2,1H3,(H,22,25)