ethyl 3-[(Z)-2-cyano-2-[1-(phenylsulfonyl)indol-3-yl]ethenyl]indole-1-carboxylate

Systemtic Name: ethyl 3-[(Z)-2-cyano-2-[1-(phenylsulfonyl)indol-3-yl]ethenyl]indole-1-carboxylate Openeye Name: ethyl 3-[(Z)-2-[1-(benzenesulfonyl)indol-3-yl]-2-cyano-vinyl]indole-1-carboxylate CAS Name: 3-[(Z)-2-[1-(benzenesulfonyl)-3-indolyl]-2-cyanoethenyl]-1-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(Z)-2-[1-(benzenesulfonyl)indol-3-yl]-2-cyanoethenyl]indole-1-carboxylate Traditional Name: 3-[(Z)-2-(1-besylindol-3-yl)-2-cyano-vinyl]indole-1-carboxylic acid ethyl ester Formula: C28H21N3O4S MolecularWeight: 495.54904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=C(C2=CC=CC=C21)C=C(C#N)C3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)N1C=C(C2=CC=CC=C21)/C=C(\C#N)/C3=CN(C4=CC=CC=C43)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O4S/c1-2-35-28(32)30-18-21(23-12-6-8-14-26(23)30)16-20(17-29)25-19-31(27-15-9-7-13-24(25)27)36(33,34)22-10-4-3-5-11-22/h3-16,18-19H,2H2,1H3/b20-16+