2-[methyl-[(Z)-3-[4-(3-methylphenyl)phenyl]-3-thiophen-3-yl-prop-2-enyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[(Z)-3-[4-(3-methylphenyl)phenyl]-3-thiophen-3-yl-prop-2-enyl]amino]ethanoic acid Openeye Name: 2-[methyl-[(Z)-3-[4-(m-tolyl)phenyl]-3-(3-thienyl)allyl]amino]acetic acid CAS Name: 2-[methyl-[(Z)-3-[4-(3-methylphenyl)phenyl]-3-(3-thiophenyl)prop-2-enyl]amino]acetic acid IUPAC Name: 2-[methyl-[(Z)-3-[4-(3-methylphenyl)phenyl]-3-thiophen-3-ylprop-2-enyl]amino]acetic acid Traditional Name: 2-[methyl-[(Z)-3-[4-(m-tolyl)phenyl]-3-(3-thienyl)allyl]amino]acetic acid Formula: C23H23NO2S MolecularWeight: 377.49922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC=C(C=C2)C(=CCN(C)CC(=O)O)C3=CSC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC=C(C=C2)/C(=C/CN(C)CC(=O)O)/C3=CSC=C3

InChI

InChI=1S/C23H23NO2S/c1-17-4-3-5-20(14-17)18-6-8-19(9-7-18)22(21-11-13-27-16-21)10-12-24(2)15-23(25)26/h3-11,13-14,16H,12,15H2,1-2H3,(H,25,26)/b22-10-