N-[(4-ethoxyphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(4-ethoxyphenyl)-(5-nitro-8-oxidanyl-quinolin-7-yl)methyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(4-ethoxyphenyl)-(8-hydroxy-5-nitro-7-quinolyl)methyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[(4-ethoxyphenyl)-(8-hydroxy-5-nitro-7-quinolinyl)methyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(4-ethoxyphenyl)-(8-hydroxy-5-nitroquinolin-7-yl)methyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(8-hydroxy-5-nitro-7-quinolyl)-p-phenetyl-methyl]-3,4,5-trimethoxy-benzamide Formula: C28H27N3O8 MolecularWeight: 533.52928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-])NC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC(=C3C=CC=NC3=C2O)[N+](=O)[O-])NC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C28H27N3O8/c1-5-39-18-10-8-16(9-11-18)24(20-15-21(31(34)35)19-7-6-12-29-25(19)26(20)32)30-28(33)17-13-22(36-2)27(38-4)23(14-17)37-3/h6-15,24,32H,5H2,1-4H3,(H,30,33)