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

Systemtic Name: (E)-3-[1-[(3-methylphenyl)methyl]indol-5-yl]but-2-enoic acid Openeye Name: (E)-3-[1-(m-tolylmethyl)indol-5-yl]but-2-enoic acid CAS Name: (E)-3-[1-[(3-methylphenyl)methyl]-5-indolyl]-2-butenoic acid IUPAC Name: (E)-3-[1-[(3-methylphenyl)methyl]indol-5-yl]but-2-enoic acid Traditional Name: (E)-3-[1-(3-methylbenzyl)indol-5-yl]but-2-enoic acid Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC3=C2C=CC(=C3)C(=CC(=O)O)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC3=C2C=CC(=C3)/C(=C/C(=O)O)/C

InChI

InChI=1S/C20H19NO2/c1-14-4-3-5-16(10-14)13-21-9-8-18-12-17(6-7-19(18)21)15(2)11-20(22)23/h3-12H,13H2,1-2H3,(H,22,23)/b15-11+