dodecyl 3-(2-cyanopropanoylamino)-4-methoxy-benzoate

Systemtic Name: dodecyl 3-(2-cyanopropanoylamino)-4-methoxy-benzoate Openeye Name: dodecyl 3-(2-cyanopropanoylamino)-4-methoxy-benzoate CAS Name: 3-[(2-cyano-1-oxopropyl)amino]-4-methoxybenzoic acid dodecyl ester IUPAC Name: dodecyl 3-(2-cyanopropanoylamino)-4-methoxybenzoate Traditional Name: 3-(2-cyanopropanoylamino)-4-methoxy-benzoic acid lauryl ester Formula: C24H36N2O4 MolecularWeight: 416.55364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OC)NC(=O)C(C)C#N

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=C(C=C1)OC)NC(=O)C(C)C#N

InChI

InChI=1S/C24H36N2O4/c1-4-5-6-7-8-9-10-11-12-13-16-30-24(28)20-14-15-22(29-3)21(17-20)26-23(27)19(2)18-25/h14-15,17,19H,4-13,16H2,1-3H3,(H,26,27)