N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-3-nitro-N-phenyl-benzamide

Systemtic Name: N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-3-nitro-N-phenyl-benzamide Openeye Name: N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-3-nitro-N-phenyl-benzamide CAS Name: N-[2-methyl-1-(1-oxobutyl)-3,4-dihydro-2H-quinolin-4-yl]-3-nitro-N-phenylbenzamide IUPAC Name: N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-3-nitro-N-phenylbenzamide Traditional Name: N-(1-butyryl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-3-nitro-N-phenyl-benzamide Formula: C27H27N3O4 MolecularWeight: 457.52098

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1C(CC(C2=CC=CC=C21)N(C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CCCC(=O)N1C(CC(C2=CC=CC=C21)N(C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C27H27N3O4/c1-3-10-26(31)28-19(2)17-25(23-15-7-8-16-24(23)28)29(21-12-5-4-6-13-21)27(32)20-11-9-14-22(18-20)30(33)34/h4-9,11-16,18-19,25H,3,10,17H2,1-2H3