(E)-3-(4-methylphenyl)-N-(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)prop-2-enamide

Systemtic Name: (E)-3-(4-methylphenyl)-N-(2-pyridin-3-yl-2-pyrrolidin-1-yl-ethyl)prop-2-enamide Openeye Name: (E)-3-(p-tolyl)-N-[2-(3-pyridyl)-2-pyrrolidin-1-yl-ethyl]prop-2-enamide CAS Name: (E)-3-(4-methylphenyl)-N-[2-(3-pyridinyl)-2-(1-pyrrolidinyl)ethyl]-2-propenamide IUPAC Name: (E)-3-(4-methylphenyl)-N-(2-pyridin-3-yl-2-pyrrolidin-1-ylethyl)prop-2-enamide Traditional Name: (E)-3-(p-tolyl)-N-[2-(3-pyridyl)-2-pyrrolidino-ethyl]acrylamide Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NCC(C2=CN=CC=C2)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NCC(C2=CN=CC=C2)N3CCCC3

InChI

InChI=1S/C21H25N3O/c1-17-6-8-18(9-7-17)10-11-21(25)23-16-20(24-13-2-3-14-24)19-5-4-12-22-15-19/h4-12,15,20H,2-3,13-14,16H2,1H3,(H,23,25)/b11-10+