dodecyl 3-[[1-(6-chloranyl-4,6-dimethyl-cyclohexa-2,4-dien-1-yl)-5-oxidanylidene-4H-pyrazol-3-yl]-ethanoyl-amino]-4-methoxy-benzoate

Systemtic Name: dodecyl 3-[[1-(6-chloranyl-4,6-dimethyl-cyclohexa-2,4-dien-1-yl)-5-oxidanylidene-4H-pyrazol-3-yl]-ethanoyl-amino]-4-methoxy-benzoate Openeye Name: dodecyl 3-[acetyl-[1-(6-chloro-4,6-dimethyl-cyclohexa-2,4-dien-1-yl)-5-oxo-4H-pyrazol-3-yl]amino]-4-methoxy-benzoate CAS Name: 3-[acetyl-[1-(6-chloro-4,6-dimethyl-1-cyclohexa-2,4-dienyl)-5-oxo-4H-pyrazol-3-yl]amino]-4-methoxybenzoic acid dodecyl ester IUPAC Name: dodecyl 3-[acetyl-[1-(6-chloro-4,6-dimethylcyclohexa-2,4-dien-1-yl)-5-oxo-4H-pyrazol-3-yl]amino]-4-methoxybenzoate Traditional Name: 3-[acetyl-[1-(6-chloro-4,6-dimethyl-cyclohexa-2,4-dien-1-yl)-5-keto-2-pyrazolin-3-yl]amino]-4-methoxy-benzoic acid lauryl ester Formula: C33H46ClN3O5 MolecularWeight: 600.18844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OC)N(C2=NN(C(=O)C2)C3C=CC(=CC3(C)Cl)C)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OC)N(C2=NN(C(=O)C2)C3C=CC(=CC3(C)Cl)C)C(=O)C

InChI

InChI=1S/C33H46ClN3O5/c1-6-7-8-9-10-11-12-13-14-15-20-42-32(40)26-17-18-28(41-5)27(21-26)36(25(3)38)30-22-31(39)37(35-30)29-19-16-24(2)23-33(29,4)34/h16-19,21,23,29H,6-15,20,22H2,1-5H3