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

Systemtic Name: (E)-3-[1-(phenylmethyl)pyrrol-2-yl]prop-2-enoic acid Openeye Name: (E)-3-(1-benzylpyrrol-2-yl)prop-2-enoic acid CAS Name: (E)-3-[1-(phenylmethyl)-2-pyrrolyl]-2-propenoic acid IUPAC Name: (E)-3-(1-benzylpyrrol-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-benzylpyrrol-2-yl)acrylic acid Formula: C14H13NO2 MolecularWeight: 227.25852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC=C2C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC=C2/C=C/C(=O)O

InChI

InChI=1S/C14H13NO2/c16-14(17)9-8-13-7-4-10-15(13)11-12-5-2-1-3-6-12/h1-10H,11H2,(H,16,17)/b9-8+