(E)-3-[1-[(2-methylphenyl)-phenyl-methyl]indol-5-yl]but-2-enoic acid

Systemtic Name: (E)-3-[1-[(2-methylphenyl)-phenyl-methyl]indol-5-yl]but-2-enoic acid Openeye Name: (E)-3-[1-[o-tolyl(phenyl)methyl]indol-5-yl]but-2-enoic acid CAS Name: (E)-3-[1-[(2-methylphenyl)-phenylmethyl]-5-indolyl]-2-butenoic acid IUPAC Name: (E)-3-[1-[(2-methylphenyl)-phenylmethyl]indol-5-yl]but-2-enoic acid Traditional Name: (E)-3-[1-[o-tolyl(phenyl)methyl]indol-5-yl]but-2-enoic acid Formula: C26H23NO2 MolecularWeight: 381.46632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2)N3C=CC4=C3C=CC(=C4)C(=CC(=O)O)C

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2)N3C=CC4=C3C=CC(=C4)/C(=C/C(=O)O)/C

InChI

InChI=1S/C26H23NO2/c1-18-8-6-7-11-23(18)26(20-9-4-3-5-10-20)27-15-14-22-17-21(12-13-24(22)27)19(2)16-25(28)29/h3-17,26H,1-2H3,(H,28,29)/b19-16+