2-[4-[1-(4-carbamimidoylphenyl)piperidin-4-yl]-1-oxidanyl-cyclohexyl]ethanoic acid

Systemtic Name: 2-[4-[1-(4-carbamimidoylphenyl)piperidin-4-yl]-1-oxidanyl-cyclohexyl]ethanoic acid Openeye Name: 2-[4-[1-(4-carbamimidoylphenyl)-4-piperidyl]-1-hydroxy-cyclohexyl]acetic acid CAS Name: 2-[4-[1-(4-carbamimidoylphenyl)-4-piperidinyl]-1-hydroxycyclohexyl]acetic acid IUPAC Name: 2-[4-[1-(4-carbamimidoylphenyl)piperidin-4-yl]-1-hydroxycyclohexyl]acetic acid Traditional Name: 2-[4-[1-(4-amidinophenyl)-4-piperidyl]-1-hydroxy-cyclohexyl]acetic acid Formula: C20H29N3O3 MolecularWeight: 359.46256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2CCN(CC2)C3=CC=C(C=C3)C(=N)N)(CC(=O)O)O

Isomeric SMILES

C1CC(CCC1C2CCN(CC2)C3=CC=C(C=C3)C(=N)N)(CC(=O)O)O

InChI

InChI=1S/C20H29N3O3/c21-19(22)16-1-3-17(4-2-16)23-11-7-15(8-12-23)14-5-9-20(26,10-6-14)13-18(24)25/h1-4,14-15,26H,5-13H2,(H3,21,22)(H,24,25)