2-(3-azanyl-2-oxidanyl-4-phenyl-butyl)-4-methoxy-cyclohexane-1-carboxylic acid

Systemtic Name: 2-(3-azanyl-2-oxidanyl-4-phenyl-butyl)-4-methoxy-cyclohexane-1-carboxylic acid Openeye Name: 2-(3-amino-2-hydroxy-4-phenyl-butyl)-4-methoxy-cyclohexanecarboxylic acid CAS Name: 2-(3-amino-2-hydroxy-4-phenylbutyl)-4-methoxy-1-cyclohexanecarboxylic acid IUPAC Name: 2-(3-amino-2-hydroxy-4-phenylbutyl)-4-methoxycyclohexane-1-carboxylic acid Traditional Name: 2-(3-amino-2-hydroxy-4-phenyl-butyl)-4-methoxy-cyclohexanecarboxylic acid Formula: C18H27NO4 MolecularWeight: 321.41128

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCC(C(C1)CC(C(CC2=CC=CC=C2)N)O)C(=O)O

Isomeric SMILES

COC1CCC(C(C1)CC(C(CC2=CC=CC=C2)N)O)C(=O)O

InChI

InChI=1S/C18H27NO4/c1-23-14-7-8-15(18(21)22)13(10-14)11-17(20)16(19)9-12-5-3-2-4-6-12/h2-6,13-17,20H,7-11,19H2,1H3,(H,21,22)