methyl 3-[[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]amino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]amino]-4-methyl-benzoate Openeye Name: methyl 3-[[(E)-3-(3-chlorobenzothiophen-2-yl)prop-2-enoyl]amino]-4-methyl-benzoate CAS Name: 3-[[(E)-3-(3-chloro-1-benzothiophen-2-yl)-1-oxoprop-2-enyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(3-chloro-1-benzothiophen-2-yl)prop-2-enoyl]amino]-4-methylbenzoate Traditional Name: 3-[[(E)-3-(3-chlorobenzothiophen-2-yl)acryloyl]amino]-4-methyl-benzoic acid methyl ester Formula: C20H16ClNO3S MolecularWeight: 385.86394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C=CC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)/C=C/C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C20H16ClNO3S/c1-12-7-8-13(20(24)25-2)11-15(12)22-18(23)10-9-17-19(21)14-5-3-4-6-16(14)26-17/h3-11H,1-2H3,(H,22,23)/b10-9+