2-[1-(phenylmethyl)indol-3-yl]prop-2-enoic acid

Systemtic Name: 2-[1-(phenylmethyl)indol-3-yl]prop-2-enoic acid Openeye Name: 2-(1-benzylindol-3-yl)prop-2-enoic acid CAS Name: 2-[1-(phenylmethyl)-3-indolyl]-2-propenoic acid IUPAC Name: 2-(1-benzylindol-3-yl)prop-2-enoic acid Traditional Name: 2-(1-benzylindol-3-yl)acrylic acid Formula: C18H15NO2 MolecularWeight: 277.3172

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C=C(C1=CN(C2=CC=CC=C21)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H15NO2/c1-13(18(20)21)16-12-19(11-14-7-3-2-4-8-14)17-10-6-5-9-15(16)17/h2-10,12H,1,11H2,(H,20,21)