1-[3-(2-chlorophenyl)prop-2-ynyl]-4-(3-nitropyridin-2-yl)piperazine

Systemtic Name: 1-[3-(2-chlorophenyl)prop-2-ynyl]-4-(3-nitropyridin-2-yl)piperazine Openeye Name: 1-[3-(2-chlorophenyl)prop-2-ynyl]-4-(3-nitro-2-pyridyl)piperazine CAS Name: 1-[3-(2-chlorophenyl)prop-2-ynyl]-4-(3-nitro-2-pyridinyl)piperazine IUPAC Name: 1-[3-(2-chlorophenyl)prop-2-ynyl]-4-(3-nitropyridin-2-yl)piperazine Traditional Name: 1-[3-(2-chlorophenyl)prop-2-ynyl]-4-(3-nitro-2-pyridyl)piperazine Formula: C18H17ClN4O2 MolecularWeight: 356.80618

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#CC2=CC=CC=C2Cl)C3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC#CC2=CC=CC=C2Cl)C3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN4O2/c19-16-7-2-1-5-15(16)6-4-10-21-11-13-22(14-12-21)18-17(23(24)25)8-3-9-20-18/h1-3,5,7-9H,10-14H2