methyl 5-chloranyl-2-[(E)-3-[4-methyl-5-(4-methylphenyl)-3-oxidanyl-thiophen-2-yl]prop-1-enyl]benzoate

Systemtic Name: methyl 5-chloranyl-2-[(E)-3-[4-methyl-5-(4-methylphenyl)-3-oxidanyl-thiophen-2-yl]prop-1-enyl]benzoate Openeye Name: methyl 5-chloro-2-[(E)-3-[3-hydroxy-4-methyl-5-(p-tolyl)-2-thienyl]prop-1-enyl]benzoate CAS Name: 5-chloro-2-[(E)-3-[3-hydroxy-4-methyl-5-(4-methylphenyl)-2-thiophenyl]prop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-[(E)-3-[3-hydroxy-4-methyl-5-(4-methylphenyl)thiophen-2-yl]prop-1-enyl]benzoate Traditional Name: 5-chloro-2-[(E)-3-[3-hydroxy-4-methyl-5-(p-tolyl)-2-thienyl]prop-1-enyl]benzoic acid methyl ester Formula: C23H21ClO3S MolecularWeight: 412.92904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C(S2)CC=CC3=C(C=C(C=C3)Cl)C(=O)OC)O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C(S2)C/C=C/C3=C(C=C(C=C3)Cl)C(=O)OC)O)C

InChI

InChI=1S/C23H21ClO3S/c1-14-7-9-17(10-8-14)22-15(2)21(25)20(28-22)6-4-5-16-11-12-18(24)13-19(16)23(26)27-3/h4-5,7-13,25H,6H2,1-3H3/b5-4+