1-(3-isocyanopyridin-2-yl)-4-(4-phenylbut-3-yn-2-yl)piperazine

Systemtic Name: 1-(3-isocyanopyridin-2-yl)-4-(4-phenylbut-3-yn-2-yl)piperazine Openeye Name: 1-(3-isocyano-2-pyridyl)-4-(1-methyl-3-phenyl-prop-2-ynyl)piperazine CAS Name: 1-(3-isocyano-2-pyridinyl)-4-(4-phenylbut-3-yn-2-yl)piperazine IUPAC Name: 1-(3-isocyanopyridin-2-yl)-4-(4-phenylbut-3-yn-2-yl)piperazine Traditional Name: 1-(3-isocyano-2-pyridyl)-4-(1-methyl-3-phenyl-prop-2-ynyl)piperazine Formula: C20H20N4 MolecularWeight: 316.3996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CC1=CC=CC=C1)N2CCN(CC2)C3=C(C=CC=N3)[N+]#[C-]

Isomeric SMILES

CC(C#CC1=CC=CC=C1)N2CCN(CC2)C3=C(C=CC=N3)[N+]#[C-]

InChI

InChI=1S/C20H20N4/c1-17(10-11-18-7-4-3-5-8-18)23-13-15-24(16-14-23)20-19(21-2)9-6-12-22-20/h3-9,12,17H,13-16H2,1H3