dodecyl 3-[[(2Z)-2-(1-ethyl-5-methyl-3H-pyrrol-2-ylidene)-2-(phenylsulfonyl)ethanoyl]amino]benzoate

Systemtic Name: dodecyl 3-[[(2Z)-2-(1-ethyl-5-methyl-3H-pyrrol-2-ylidene)-2-(phenylsulfonyl)ethanoyl]amino]benzoate Openeye Name: dodecyl 3-[[(2Z)-2-(benzenesulfonyl)-2-(1-ethyl-5-methyl-3H-pyrrol-2-ylidene)acetyl]amino]benzoate CAS Name: 3-[[(2Z)-2-(benzenesulfonyl)-2-(1-ethyl-5-methyl-3H-pyrrol-2-ylidene)-1-oxoethyl]amino]benzoic acid dodecyl ester IUPAC Name: dodecyl 3-[[(2Z)-2-(benzenesulfonyl)-2-(1-ethyl-5-methyl-3H-pyrrol-2-ylidene)acetyl]amino]benzoate Traditional Name: 3-[[(2Z)-2-besyl-2-(1-ethyl-5-methyl-2-pyrrolin-2-ylidene)acetyl]amino]benzoic acid lauryl ester Formula: C34H46N2O5S MolecularWeight: 594.80444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC(=O)C(=C2CC=C(N2CC)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)NC(=O)/C(=C/2\CC=C(N2CC)C)/S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C34H46N2O5S/c1-4-6-7-8-9-10-11-12-13-17-25-41-34(38)28-19-18-20-29(26-28)35-33(37)32(31-24-23-27(3)36(31)5-2)42(39,40)30-21-15-14-16-22-30/h14-16,18-23,26H,4-13,17,24-25H2,1-3H3,(H,35,37)/b32-31-