(2-benzamido-2-oxidanylidene-ethyl) 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: (2-benzamido-2-oxo-ethyl) 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate CAS Name: 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Traditional Name: 9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylic acid (2-benzamido-2-keto-ethyl) ester Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=CC(=C3)C(=O)OCC(=O)NC(=O)C4=CC=CC=C4)C(=O)N2C1

Isomeric SMILES

C1CC2=NC3=C(C=CC(=C3)C(=O)OCC(=O)NC(=O)C4=CC=CC=C4)C(=O)N2C1

InChI

InChI=1S/C21H17N3O5/c25-18(23-19(26)13-5-2-1-3-6-13)12-29-21(28)14-8-9-15-16(11-14)22-17-7-4-10-24(17)20(15)27/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,23,25,26)