1-(4-methyl-3-nitro-pyridin-2-yl)-4-(3-phenylprop-2-ynyl)piperazine

Systemtic Name: 1-(4-methyl-3-nitro-pyridin-2-yl)-4-(3-phenylprop-2-ynyl)piperazine Openeye Name: 1-(4-methyl-3-nitro-2-pyridyl)-4-(3-phenylprop-2-ynyl)piperazine CAS Name: 1-(4-methyl-3-nitro-2-pyridinyl)-4-(3-phenylprop-2-ynyl)piperazine IUPAC Name: 1-(4-methyl-3-nitropyridin-2-yl)-4-(3-phenylprop-2-ynyl)piperazine Traditional Name: 1-(4-methyl-3-nitro-2-pyridyl)-4-(3-phenylprop-2-ynyl)piperazine Formula: C19H20N4O2 MolecularWeight: 336.3877

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)N2CCN(CC2)CC#CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC=C1)N2CCN(CC2)CC#CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N4O2/c1-16-9-10-20-19(18(16)23(24)25)22-14-12-21(13-15-22)11-5-8-17-6-3-2-4-7-17/h2-4,6-7,9-10H,11-15H2,1H3