3-(2-methoxy-4-pyrrolidin-1-yl-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(2-methoxy-4-pyrrolidin-1-yl-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(2-methoxy-4-pyrrolidin-1-yl-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-[2-methoxy-4-(1-pyrrolidinyl)phenyl]-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(2-methoxy-4-pyrrolidin-1-ylphenyl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(2-methoxy-4-pyrrolidino-phenyl)-2-(3-nitrophenyl)acrylonitrile Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCCC2)C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCCC2)C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O3/c1-26-20-13-18(22-9-2-3-10-22)8-7-16(20)11-17(14-21)15-5-4-6-19(12-15)23(24)25/h4-8,11-13H,2-3,9-10H2,1H3