(E)-2-cyano-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-N-(3-ethoxypropyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-N-(3-ethoxypropyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-N-(3-ethoxypropyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-N-(3-ethoxypropyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(2,5-dimethyl-1-phenylpyrrol-3-yl)-N-(3-ethoxypropyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-N-(3-ethoxypropyl)acrylamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C(=CC1=C(N(C(=C1)C)C2=CC=CC=C2)C)C#N

Isomeric SMILES

CCOCCCNC(=O)/C(=C/C1=C(N(C(=C1)C)C2=CC=CC=C2)C)/C#N

InChI

InChI=1S/C21H25N3O2/c1-4-26-12-8-11-23-21(25)19(15-22)14-18-13-16(2)24(17(18)3)20-9-6-5-7-10-20/h5-7,9-10,13-14H,4,8,11-12H2,1-3H3,(H,23,25)/b19-14+