1-[4-[2-[1-[(4-dimethylaminophenyl)methyl]piperidin-4-yl]-6-methyl-pyridin-3-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[2-[1-[(4-dimethylaminophenyl)methyl]piperidin-4-yl]-6-methyl-pyridin-3-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[2-[1-[(4-dimethylaminophenyl)methyl]-4-piperidyl]-6-methyl-pyridine-3-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[2-[1-[(4-dimethylaminophenyl)methyl]-4-piperidinyl]-6-methyl-3-pyridinyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-[1-[(4-dimethylaminophenyl)methyl]piperidin-4-yl]-6-methylpyridine-3-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-[1-[4-(dimethylamino)benzyl]-4-piperidyl]-6-methyl-nicotinoyl]piperazino]ethanone Formula: C27H37N5O2 MolecularWeight: 463.61498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C(=O)C)C3CCN(CC3)CC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)N2CCN(CC2)C(=O)C)C3CCN(CC3)CC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C27H37N5O2/c1-20-5-10-25(27(34)32-17-15-31(16-18-32)21(2)33)26(28-20)23-11-13-30(14-12-23)19-22-6-8-24(9-7-22)29(3)4/h5-10,23H,11-19H2,1-4H3