dodecyl 2,4-bis(chloranyl)-5-[(7-methyl-1-oxidanyl-naphthalen-2-yl)carbonylamino]benzoate

Systemtic Name: dodecyl 2,4-bis(chloranyl)-5-[(7-methyl-1-oxidanyl-naphthalen-2-yl)carbonylamino]benzoate Openeye Name: dodecyl 2,4-dichloro-5-[(1-hydroxy-7-methyl-naphthalene-2-carbonyl)amino]benzoate CAS Name: 2,4-dichloro-5-[[(1-hydroxy-7-methyl-2-naphthalenyl)-oxomethyl]amino]benzoic acid dodecyl ester IUPAC Name: dodecyl 2,4-dichloro-5-[(1-hydroxy-7-methylnaphthalene-2-carbonyl)amino]benzoate Traditional Name: 2,4-dichloro-5-[(1-hydroxy-7-methyl-2-naphthoyl)amino]benzoic acid lauryl ester Formula: C31H37Cl2NO4 MolecularWeight: 558.53578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1Cl)Cl)NC(=O)C2=C(C3=C(C=CC(=C3)C)C=C2)O

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1Cl)Cl)NC(=O)C2=C(C3=C(C=CC(=C3)C)C=C2)O

InChI

InChI=1S/C31H37Cl2NO4/c1-3-4-5-6-7-8-9-10-11-12-17-38-31(37)25-19-28(27(33)20-26(25)32)34-30(36)23-16-15-22-14-13-21(2)18-24(22)29(23)35/h13-16,18-20,35H,3-12,17H2,1-2H3,(H,34,36)