1-(3-methyl-5-nitro-imidazol-4-yl)-4-(4-phenylbut-3-yn-2-ylidene)piperidine

Systemtic Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(4-phenylbut-3-yn-2-ylidene)piperidine Openeye Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(1-methyl-3-phenyl-prop-2-ynylidene)piperidine CAS Name: 1-(3-methyl-5-nitro-4-imidazolyl)-4-(4-phenylbut-3-yn-2-ylidene)piperidine IUPAC Name: 1-(3-methyl-5-nitroimidazol-4-yl)-4-(4-phenylbut-3-yn-2-ylidene)piperidine Traditional Name: 1-(3-methyl-5-nitro-imidazol-4-yl)-4-(1-methyl-3-phenyl-prop-2-ynylidene)piperidine Formula: C19H20N4O2 MolecularWeight: 336.3877

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1CCN(CC1)C2=C(N=CN2C)[N+](=O)[O-])C#CC3=CC=CC=C3

Isomeric SMILES

CC(=C1CCN(CC1)C2=C(N=CN2C)[N+](=O)[O-])C#CC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O2/c1-15(8-9-16-6-4-3-5-7-16)17-10-12-22(13-11-17)19-18(23(24)25)20-14-21(19)2/h3-7,14H,10-13H2,1-2H3