(3-chlorophenyl)-(4-piperidin-1-ium-4-ylpiperazin-1-yl)methanone

Systemtic Name: (3-chlorophenyl)-(4-piperidin-1-ium-4-ylpiperazin-1-yl)methanone Openeye Name: (3-chlorophenyl)-(4-piperidin-1-ium-4-ylpiperazin-1-yl)methanone CAS Name: (3-chlorophenyl)-[4-(4-piperidin-1-iumyl)-1-piperazinyl]methanone IUPAC Name: (3-chlorophenyl)-(4-piperidin-1-ium-4-ylpiperazin-1-yl)methanone Traditional Name: (3-chlorophenyl)-(4-piperidin-1-ium-4-ylpiperazino)methanone Formula: C16H23ClN3O+ MolecularWeight: 308.82632

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1N2CCN(CC2)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C1C[NH2+]CCC1N2CCN(CC2)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H22ClN3O/c17-14-3-1-2-13(12-14)16(21)20-10-8-19(9-11-20)15-4-6-18-7-5-15/h1-3,12,15,18H,4-11H2/p+1