ethyl (1E)-N-[3-cyano-5-methyl-4-(phenylmethyl)-1H-pyrrol-2-yl]methanimidate

Systemtic Name: ethyl (1E)-N-[3-cyano-5-methyl-4-(phenylmethyl)-1H-pyrrol-2-yl]methanimidate Openeye Name: ethyl (1E)-N-(4-benzyl-3-cyano-5-methyl-1H-pyrrol-2-yl)methanimidate CAS Name: (1E)-N-[3-cyano-5-methyl-4-(phenylmethyl)-1H-pyrrol-2-yl]methanimidic acid ethyl ester IUPAC Name: ethyl (1E)-N-(4-benzyl-3-cyano-5-methyl-1H-pyrrol-2-yl)methanimidate Traditional Name: (1E)-N-(4-benzyl-3-cyano-5-methyl-1H-pyrrol-2-yl)formimidic acid ethyl ester Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(C(=C(N1)C)CC2=CC=CC=C2)C#N

Isomeric SMILES

CCO/C=N/C1=C(C(=C(N1)C)CC2=CC=CC=C2)C#N

InChI

InChI=1S/C16H17N3O/c1-3-20-11-18-16-15(10-17)14(12(2)19-16)9-13-7-5-4-6-8-13/h4-8,11,19H,3,9H2,1-2H3/b18-11+