1-ethyl-N-[(4-piperazin-1-ylphenyl)methyl]piperidine-4-carboxamide ethanoate

Systemtic Name: 1-ethyl-N-[(4-piperazin-1-ylphenyl)methyl]piperidine-4-carboxamide ethanoate Openeye Name: 1-ethyl-N-[(4-piperazin-1-ylphenyl)methyl]piperidine-4-carboxamide acetate CAS Name: 1-ethyl-N-[[4-(1-piperazinyl)phenyl]methyl]-4-piperidinecarboxamide acetate IUPAC Name: 1-ethyl-N-[(4-piperazin-1-ylphenyl)methyl]piperidine-4-carboxamide acetate Traditional Name: 1-ethyl-N-(4-piperazinobenzyl)isonipecotamide acetate Formula: C21H33N4O3- MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)C(=O)NCC2=CC=C(C=C2)N3CCNCC3.CC(=O)[O-]

Isomeric SMILES

CCN1CCC(CC1)C(=O)NCC2=CC=C(C=C2)N3CCNCC3.CC(=O)[O-]

InChI

InChI=1S/C19H30N4O.C2H4O2/c1-2-22-11-7-17(8-12-22)19(24)21-15-16-3-5-18(6-4-16)23-13-9-20-10-14-23;1-2(3)4/h3-6,17,20H,2,7-15H2,1H3,(H,21,24);1H3,(H,3,4)/p-1