1-[1-azanyl-2-(4-pyridin-4-ylpiperazin-1-yl)cyclohexyl]propan-1-one; carbonic acid

Systemtic Name: 1-[1-azanyl-2-(4-pyridin-4-ylpiperazin-1-yl)cyclohexyl]propan-1-one; carbonic acid Openeye Name: 1-[1-amino-2-[4-(4-pyridyl)piperazin-1-yl]cyclohexyl]propan-1-one; carbonic acid CAS Name: 1-[1-amino-2-(4-pyridin-4-yl-1-piperazinyl)cyclohexyl]-1-propanone; carbonic acid IUPAC Name: 1-[1-amino-2-(4-pyridin-4-ylpiperazin-1-yl)cyclohexyl]propan-1-one; carbonic acid Traditional Name: 1-[1-amino-2-[4-(4-pyridyl)piperazino]cyclohexyl]propan-1-one; carbonic acid Formula: C19H30N4O4 MolecularWeight: 378.4659

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(CCCCC1N2CCN(CC2)C3=CC=NC=C3)N.C(=O)(O)O

Isomeric SMILES

CCC(=O)C1(CCCCC1N2CCN(CC2)C3=CC=NC=C3)N.C(=O)(O)O

InChI

InChI=1S/C18H28N4O.CH2O3/c1-2-17(23)18(19)8-4-3-5-16(18)22-13-11-21(12-14-22)15-6-9-20-10-7-15;2-1(3)4/h6-7,9-10,16H,2-5,8,11-14,19H2,1H3;(H2,2,3,4)