(Z)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[(2-nitrophenyl)methyl]prop-2-enamide

Systemtic Name: (Z)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[(2-nitrophenyl)methyl]prop-2-enamide Openeye Name: (Z)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-[(2-nitrophenyl)methyl]prop-2-enamide CAS Name: (Z)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-N-[(2-nitrophenyl)methyl]-2-propenamide IUPAC Name: (Z)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)-N-[(2-nitrophenyl)methyl]prop-2-enamide Traditional Name: (Z)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)-N-(2-nitrobenzyl)acrylamide Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)NCC2=CC=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(/C#N)\C(=O)NCC2=CC=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C20H22N4O3/c1-4-9-23-14(2)10-17(15(23)3)11-18(12-21)20(25)22-13-16-7-5-6-8-19(16)24(26)27/h5-8,10-11H,4,9,13H2,1-3H3,(H,22,25)/b18-11-