[2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoate

Systemtic Name: [2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] (E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoate Openeye Name: [2-(2-methyl-1H-indol-3-yl)-2-oxo-ethyl] (E)-3-(3-chlorobenzothiophen-2-yl)prop-2-enoate CAS Name: (E)-3-(3-chloro-1-benzothiophen-2-yl)-2-propenoic acid [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-1H-indol-3-yl)-2-oxoethyl] (E)-3-(3-chloro-1-benzothiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(3-chlorobenzothiophen-2-yl)acrylic acid [2-keto-2-(2-methyl-1H-indol-3-yl)ethyl] ester Formula: C22H16ClNO3S MolecularWeight: 409.88534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)C=CC3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)/C=C/C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C22H16ClNO3S/c1-13-21(14-6-2-4-8-16(14)24-13)17(25)12-27-20(26)11-10-19-22(23)15-7-3-5-9-18(15)28-19/h2-11,24H,12H2,1H3/b11-10+