(Z)-2-methyl-3-[1-(phenylmethyl)indol-5-yl]but-2-enoic acid

Systemtic Name: (Z)-2-methyl-3-[1-(phenylmethyl)indol-5-yl]but-2-enoic acid Openeye Name: (Z)-3-(1-benzylindol-5-yl)-2-methyl-but-2-enoic acid CAS Name: (Z)-2-methyl-3-[1-(phenylmethyl)-5-indolyl]-2-butenoic acid IUPAC Name: (Z)-3-(1-benzylindol-5-yl)-2-methylbut-2-enoic acid Traditional Name: (Z)-3-(1-benzylindol-5-yl)-2-methyl-but-2-enoic acid Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)C(=O)O)C1=CC2=C(C=C1)N(C=C2)CC3=CC=CC=C3

Isomeric SMILES

C/C(=C(\C)/C(=O)O)/C1=CC2=C(C=C1)N(C=C2)CC3=CC=CC=C3

InChI

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