3-[3-(1H-indol-5-yl)-4-methyl-phenyl]propanoic acid

Systemtic Name: 3-[3-(1H-indol-5-yl)-4-methyl-phenyl]propanoic acid Openeye Name: 3-[3-(1H-indol-5-yl)-4-methyl-phenyl]propanoic acid CAS Name: 3-[3-(1H-indol-5-yl)-4-methylphenyl]propanoic acid IUPAC Name: 3-[3-(1H-indol-5-yl)-4-methylphenyl]propanoic acid Traditional Name: 3-[3-(1H-indol-5-yl)-4-methyl-phenyl]propionic acid Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)O)C2=CC3=C(C=C2)NC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)O)C2=CC3=C(C=C2)NC=C3

InChI

InChI=1S/C18H17NO2/c1-12-2-3-13(4-7-18(20)21)10-16(12)14-5-6-17-15(11-14)8-9-19-17/h2-3,5-6,8-11,19H,4,7H2,1H3,(H,20,21)