1-[4-[4-[1-(4-isocyanophenyl)ethyl]-3-methyl-piperazin-1-yl]-4-methyl-piperidin-1-yl]ethanone

Systemtic Name: 1-[4-[4-[1-(4-isocyanophenyl)ethyl]-3-methyl-piperazin-1-yl]-4-methyl-piperidin-1-yl]ethanone Openeye Name: 1-[4-[4-[1-(4-isocyanophenyl)ethyl]-3-methyl-piperazin-1-yl]-4-methyl-1-piperidyl]ethanone CAS Name: 1-[4-[4-[1-(4-isocyanophenyl)ethyl]-3-methyl-1-piperazinyl]-4-methyl-1-piperidinyl]ethanone IUPAC Name: 1-[4-[4-[1-(4-isocyanophenyl)ethyl]-3-methylpiperazin-1-yl]-4-methylpiperidin-1-yl]ethanone Traditional Name: 1-[4-[4-[1-(4-isocyanophenyl)ethyl]-3-methyl-piperazino]-4-methyl-piperidino]ethanone Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(C)C2=CC=C(C=C2)[N+]#[C-])C3(CCN(CC3)C(=O)C)C

Isomeric SMILES

CC1CN(CCN1C(C)C2=CC=C(C=C2)[N+]#[C-])C3(CCN(CC3)C(=O)C)C

InChI

InChI=1S/C22H32N4O/c1-17-16-25(22(4)10-12-24(13-11-22)19(3)27)14-15-26(17)18(2)20-6-8-21(23-5)9-7-20/h6-9,17-18H,10-16H2,1-4H3