2-[4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-cyclohexyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-cyclohexyl-N-propan-2-yl-ethanamide Openeye Name: 2-[4-[2-(2-chloroanilino)-2-oxo-ethyl]piperazin-1-ium-1-yl]-N-cyclohexyl-N-isopropyl-acetamide CAS Name: 2-[4-[2-(2-chloroanilino)-2-oxoethyl]-1-piperazin-1-iumyl]-N-cyclohexyl-N-propan-2-ylacetamide IUPAC Name: 2-[4-[2-(2-chloroanilino)-2-oxoethyl]piperazin-1-ium-1-yl]-N-cyclohexyl-N-propan-2-ylacetamide Traditional Name: 2-[4-[2-(2-chloroanilino)-2-keto-ethyl]piperazin-1-ium-1-yl]-N-cyclohexyl-N-isopropyl-acetamide Formula: C23H36ClN4O2+ MolecularWeight: 436.01054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1CCCCC1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(C)N(C1CCCCC1)C(=O)C[NH+]2CCN(CC2)CC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C23H35ClN4O2/c1-18(2)28(19-8-4-3-5-9-19)23(30)17-27-14-12-26(13-15-27)16-22(29)25-21-11-7-6-10-20(21)24/h6-7,10-11,18-19H,3-5,8-9,12-17H2,1-2H3,(H,25,29)/p+1