1-(2-nitrophenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-nitrophenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(2-nitrophenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide CAS Name: 1-(2-nitrophenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(2-nitrophenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]piperidine-4-carboxamide Traditional Name: N-benzyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]-1-(2-nitrophenyl)isonipecotamide Formula: C28H27N5O4 MolecularWeight: 497.54508

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C28H27N5O4/c34-27-22-10-4-5-11-23(22)29-26(30-27)19-32(18-20-8-2-1-3-9-20)28(35)21-14-16-31(17-15-21)24-12-6-7-13-25(24)33(36)37/h1-13,21H,14-19H2,(H,29,30,34)