N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(3-nitrophenyl)methyl]-2-[(phenylmethyl)amino]ethanamide

Systemtic Name: N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)-(3-nitrophenyl)methyl]-2-[(phenylmethyl)amino]ethanamide Openeye Name: 2-(benzylamino)-N-[(5-chloro-8-hydroxy-7-quinolyl)-(3-nitrophenyl)methyl]acetamide CAS Name: N-[(5-chloro-8-hydroxy-7-quinolinyl)-(3-nitrophenyl)methyl]-2-[(phenylmethyl)amino]acetamide IUPAC Name: 2-(benzylamino)-N-[(5-chloro-8-hydroxyquinolin-7-yl)-(3-nitrophenyl)methyl]acetamide Traditional Name: 2-(benzylamino)-N-[(5-chloro-8-hydroxy-7-quinolyl)-(3-nitrophenyl)methyl]acetamide Formula: C25H21ClN4O4 MolecularWeight: 476.91164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNCC(=O)NC(C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNCC(=O)NC(C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C25H21ClN4O4/c26-21-13-20(25(32)24-19(21)10-5-11-28-24)23(17-8-4-9-18(12-17)30(33)34)29-22(31)15-27-14-16-6-2-1-3-7-16/h1-13,23,27,32H,14-15H2,(H,29,31)