[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]ethanoate

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]ethanoate Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]acetate CAS Name: 2-[(4-ethoxyphenyl)sulfonylamino]acetic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]acetate Traditional Name: 2-(p-phenetylsulfonylamino)acetic acid [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester Formula: C19H18ClN3O6S MolecularWeight: 451.88072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C19H18ClN3O6S/c1-2-28-15-5-7-16(8-6-15)30(26,27)22-11-19(25)29-12-18(24)23-14-4-3-13(10-21)17(20)9-14/h3-9,22H,2,11-12H2,1H3,(H,23,24)