2-[1-oxidanyl-4-[(4-piperazin-1-ylphenyl)carbamoyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-oxidanyl-4-[(4-piperazin-1-ylphenyl)carbamoyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-hydroxy-4-[(4-piperazin-1-ylphenyl)carbamoyl]cyclohexyl]acetic acid CAS Name: 2-[1-hydroxy-4-[oxo-[4-(1-piperazinyl)anilino]methyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-hydroxy-4-[(4-piperazin-1-ylphenyl)carbamoyl]cyclohexyl]acetic acid Traditional Name: 2-[1-hydroxy-4-[(4-piperazinophenyl)carbamoyl]cyclohexyl]acetic acid Formula: C19H27N3O4 MolecularWeight: 361.43538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)NC2=CC=C(C=C2)N3CCNCC3)(CC(=O)O)O

Isomeric SMILES

C1CC(CCC1C(=O)NC2=CC=C(C=C2)N3CCNCC3)(CC(=O)O)O

InChI

InChI=1S/C19H27N3O4/c23-17(24)13-19(26)7-5-14(6-8-19)18(25)21-15-1-3-16(4-2-15)22-11-9-20-10-12-22/h1-4,14,20,26H,5-13H2,(H,21,25)(H,23,24)