N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-(3-nitrophenyl)benzamide; propan-2-ol

Systemtic Name: N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-(3-nitrophenyl)benzamide; propan-2-ol Openeye Name: N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-(3-nitrophenyl)benzamide; propan-2-ol CAS Name: N-[2-methyl-1-(1-oxobutyl)-3,4-dihydro-2H-quinolin-4-yl]-N-(3-nitrophenyl)benzamide; 2-propanol IUPAC Name: N-(1-butanoyl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-(3-nitrophenyl)benzamide; propan-2-ol Traditional Name: N-(1-butyryl-2-methyl-3,4-dihydro-2H-quinolin-4-yl)-N-(3-nitrophenyl)benzamide; propan-2-ol Formula: C30H35N3O5 MolecularWeight: 517.616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27N3O4.C3H8O/c1-3-10-26(31)28-19(2)17-25(23-15-7-8-16-24(23)28)29(27(32)20-11-5-4-6-12-20)21-13-9-14-22(18-21)30(33)34;1-3(2)4/h4-9,11-16,18-19,25H,3,10,17H2,1-2H3;3-4H,1-2H3