(Z)-2-methyl-3-[1-phenyl-5-(pyridin-3-ylmethyl)pyrrol-2-yl]prop-2-enoic acid

Systemtic Name: (Z)-2-methyl-3-[1-phenyl-5-(pyridin-3-ylmethyl)pyrrol-2-yl]prop-2-enoic acid Openeye Name: (Z)-2-methyl-3-[1-phenyl-5-(3-pyridylmethyl)pyrrol-2-yl]prop-2-enoic acid CAS Name: (Z)-2-methyl-3-[1-phenyl-5-(3-pyridinylmethyl)-2-pyrrolyl]-2-propenoic acid IUPAC Name: (Z)-2-methyl-3-[1-phenyl-5-(pyridin-3-ylmethyl)pyrrol-2-yl]prop-2-enoic acid Traditional Name: (Z)-2-methyl-3-[1-phenyl-5-(3-pyridylmethyl)pyrrol-2-yl]acrylic acid Formula: C20H18N2O2 MolecularWeight: 318.36912

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(N1C2=CC=CC=C2)CC3=CN=CC=C3)C(=O)O

Isomeric SMILES

C/C(=C/C1=CC=C(N1C2=CC=CC=C2)CC3=CN=CC=C3)/C(=O)O

InChI

InChI=1S/C20H18N2O2/c1-15(20(23)24)12-18-9-10-19(13-16-6-5-11-21-14-16)22(18)17-7-3-2-4-8-17/h2-12,14H,13H2,1H3,(H,23,24)/b15-12-