[2-[[3-oxidanylidene-5-(phenylmethyl)piperazin-1-yl]methyl]cyclohexyl]carbamic acid

Systemtic Name: [2-[[3-oxidanylidene-5-(phenylmethyl)piperazin-1-yl]methyl]cyclohexyl]carbamic acid Openeye Name: [2-[(3-benzyl-5-oxo-piperazin-1-yl)methyl]cyclohexyl]carbamic acid CAS Name: [2-[[3-oxo-5-(phenylmethyl)-1-piperazinyl]methyl]cyclohexyl]carbamic acid IUPAC Name: [2-[(3-benzyl-5-oxopiperazin-1-yl)methyl]cyclohexyl]carbamic acid Traditional Name: [2-[(3-benzyl-5-keto-piperazino)methyl]cyclohexyl]carbamic acid Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CN2CC(NC(=O)C2)CC3=CC=CC=C3)NC(=O)O

Isomeric SMILES

C1CCC(C(C1)CN2CC(NC(=O)C2)CC3=CC=CC=C3)NC(=O)O

InChI

InChI=1S/C19H27N3O3/c23-18-13-22(11-15-8-4-5-9-17(15)21-19(24)25)12-16(20-18)10-14-6-2-1-3-7-14/h1-3,6-7,15-17,21H,4-5,8-13H2,(H,20,23)(H,24,25)