2-[(1-dodecyl-3,4-dihydro-2H-quinolin-6-yl)diazenyl]-3-nitro-benzoic acid

Systemtic Name: 2-[(1-dodecyl-3,4-dihydro-2H-quinolin-6-yl)diazenyl]-3-nitro-benzoic acid Openeye Name: 2-[(1-dodecyl-3,4-dihydro-2H-quinolin-6-yl)azo]-3-nitro-benzoic acid CAS Name: 2-[(1-dodecyl-3,4-dihydro-2H-quinolin-6-yl)azo]-3-nitrobenzoic acid IUPAC Name: 2-[(1-dodecyl-3,4-dihydro-2H-quinolin-6-yl)diazenyl]-3-nitrobenzoic acid Traditional Name: 2-[(1-lauryl-3,4-dihydro-2H-quinolin-6-yl)azo]-3-nitro-benzoic acid Formula: C28H38N4O4 MolecularWeight: 494.62572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1CCCC2=C1C=CC(=C2)N=NC3=C(C=CC=C3[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCCCCCCCCCCN1CCCC2=C1C=CC(=C2)N=NC3=C(C=CC=C3[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C28H38N4O4/c1-2-3-4-5-6-7-8-9-10-11-19-31-20-13-14-22-21-23(17-18-25(22)31)29-30-27-24(28(33)34)15-12-16-26(27)32(35)36/h12,15-18,21H,2-11,13-14,19-20H2,1H3,(H,33,34)