[3-cyclohexyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]carbamic acid

Systemtic Name: [3-cyclohexyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]carbamic acid Openeye Name: [1-(cyclohexylmethyl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]carbamic acid CAS Name: [3-cyclohexyl-1-[4-(2-methoxyphenyl)-1-piperazinyl]-1-oxopropan-2-yl]carbamic acid IUPAC Name: [3-cyclohexyl-1-[4-(2-methoxyphenyl)piperazin-1-yl]-1-oxopropan-2-yl]carbamic acid Traditional Name: [1-(cyclohexylmethyl)-2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]carbamic acid Formula: C21H31N3O4 MolecularWeight: 389.48854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)C(CC3CCCCC3)NC(=O)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)C(CC3CCCCC3)NC(=O)O

InChI

InChI=1S/C21H31N3O4/c1-28-19-10-6-5-9-18(19)23-11-13-24(14-12-23)20(25)17(22-21(26)27)15-16-7-3-2-4-8-16/h5-6,9-10,16-17,22H,2-4,7-8,11-15H2,1H3,(H,26,27)