1-[3-(4-methylphenyl)prop-2-ynyl]-4-(2-nitrophenyl)piperazine

Systemtic Name: 1-[3-(4-methylphenyl)prop-2-ynyl]-4-(2-nitrophenyl)piperazine Openeye Name: 1-(2-nitrophenyl)-4-[3-(p-tolyl)prop-2-ynyl]piperazine CAS Name: 1-[3-(4-methylphenyl)prop-2-ynyl]-4-(2-nitrophenyl)piperazine IUPAC Name: 1-[3-(4-methylphenyl)prop-2-ynyl]-4-(2-nitrophenyl)piperazine Traditional Name: 1-(2-nitrophenyl)-4-[3-(p-tolyl)prop-2-ynyl]piperazine Formula: C20H21N3O2 MolecularWeight: 335.39964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CCN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C#CCN2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O2/c1-17-8-10-18(11-9-17)5-4-12-21-13-15-22(16-14-21)19-6-2-3-7-20(19)23(24)25/h2-3,6-11H,12-16H2,1H3