6-[6-(dimethylamino)hexyl]-2-(4-nitrophenyl)carbonyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[6-(dimethylamino)hexyl]-2-(4-nitrophenyl)carbonyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[6-(dimethylamino)hexyl]-2-(4-nitrobenzoyl)cyclohexa-2,4-dien-1-one CAS Name: 6-[6-(dimethylamino)hexyl]-2-[(4-nitrophenyl)-oxomethyl]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[6-(dimethylamino)hexyl]-2-(4-nitrobenzoyl)cyclohexa-2,4-dien-1-one Traditional Name: 6-[6-(dimethylamino)hexyl]-2-(4-nitrobenzoyl)cyclohexa-2,4-dien-1-one Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCCCC1C=CC=C(C1=O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCCCCC1C=CC=C(C1=O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O4/c1-22(2)15-6-4-3-5-8-16-9-7-10-19(20(16)24)21(25)17-11-13-18(14-12-17)23(26)27/h7,9-14,16H,3-6,8,15H2,1-2H3