1-tert-butyl-N-[4-(4-methylpiperazin-1-yl)phenyl]piperidine-4-carboxamide ethanoate

Systemtic Name: 1-tert-butyl-N-[4-(4-methylpiperazin-1-yl)phenyl]piperidine-4-carboxamide ethanoate Openeye Name: 1-tert-butyl-N-[4-(4-methylpiperazin-1-yl)phenyl]piperidine-4-carboxamide acetate CAS Name: 1-tert-butyl-N-[4-(4-methyl-1-piperazinyl)phenyl]-4-piperidinecarboxamide acetate IUPAC Name: 1-tert-butyl-N-[4-(4-methylpiperazin-1-yl)phenyl]piperidine-4-carboxamide acetate Traditional Name: 1-tert-butyl-N-[4-(4-methylpiperazino)phenyl]isonipecotamide acetate Formula: C23H37N4O3- MolecularWeight: 417.56488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(C)(C)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CC(=O)[O-].CC(C)(C)N1CCC(CC1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C21H34N4O.C2H4O2/c1-21(2,3)25-11-9-17(10-12-25)20(26)22-18-5-7-19(8-6-18)24-15-13-23(4)14-16-24;1-2(3)4/h5-8,17H,9-16H2,1-4H3,(H,22,26);1H3,(H,3,4)/p-1