1-(2,2,4-trimethyl-6-nitro-4-phenyl-3H-quinolin-1-yl)hexan-1-one

Systemtic Name: 1-(2,2,4-trimethyl-6-nitro-4-phenyl-3H-quinolin-1-yl)hexan-1-one Openeye Name: 1-(2,2,4-trimethyl-6-nitro-4-phenyl-3H-quinolin-1-yl)hexan-1-one CAS Name: 1-(2,2,4-trimethyl-6-nitro-4-phenyl-3H-quinolin-1-yl)-1-hexanone IUPAC Name: 1-(2,2,4-trimethyl-6-nitro-4-phenyl-3H-quinolin-1-yl)hexan-1-one Traditional Name: 1-(2,2,4-trimethyl-6-nitro-4-phenyl-3H-quinolin-1-yl)hexan-1-one Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(CC1(C)C)(C)C3=CC=CC=C3

Isomeric SMILES

CCCCCC(=O)N1C2=C(C=C(C=C2)[N+](=O)[O-])C(CC1(C)C)(C)C3=CC=CC=C3

InChI

InChI=1S/C24H30N2O3/c1-5-6-8-13-22(27)25-21-15-14-19(26(28)29)16-20(21)24(4,17-23(25,2)3)18-11-9-7-10-12-18/h7,9-12,14-16H,5-6,8,13,17H2,1-4H3