N-[4-[(E)-2-cyano-3-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-3-oxidanylidene-prop-1-enyl]phenyl]ethanamide

Systemtic Name: N-[4-[(E)-2-cyano-3-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-3-oxidanylidene-prop-1-enyl]phenyl]ethanamide Openeye Name: N-[4-[(E)-3-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-3-oxo-prop-1-enyl]phenyl]acetamide CAS Name: N-[4-[(E)-2-cyano-3-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-3-oxoprop-1-enyl]phenyl]acetamide IUPAC Name: N-[4-[(E)-2-cyano-3-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-3-oxoprop-1-enyl]phenyl]acetamide Traditional Name: N-[4-[(E)-3-(1-allyl-2,5-dimethyl-pyrrol-3-yl)-2-cyano-3-keto-prop-1-enyl]phenyl]acetamide Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC=C)C)C(=O)C(=CC2=CC=C(C=C2)NC(=O)C)C#N

Isomeric SMILES

CC1=CC(=C(N1CC=C)C)C(=O)/C(=C/C2=CC=C(C=C2)NC(=O)C)/C#N

InChI

InChI=1S/C21H21N3O2/c1-5-10-24-14(2)11-20(15(24)3)21(26)18(13-22)12-17-6-8-19(9-7-17)23-16(4)25/h5-9,11-12H,1,10H2,2-4H3,(H,23,25)/b18-12+