2-azanyl-4-cyclohexyl-6-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]-3-oxidanylidene-hexanoic acid

Systemtic Name: 2-azanyl-4-cyclohexyl-6-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidin-1-yl]-3-oxidanylidene-hexanoic acid Openeye Name: 2-amino-4-cyclohexyl-6-[4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidyl]-3-oxo-hexanoic acid CAS Name: 2-amino-4-cyclohexyl-6-[4-(3-hydroxyphenyl)-3,4-dimethyl-1-piperidinyl]-3-oxohexanoic acid IUPAC Name: 2-amino-4-cyclohexyl-6-[4-(3-hydroxyphenyl)-3,4-dimethylpiperidin-1-yl]-3-oxohexanoic acid Traditional Name: 2-amino-4-cyclohexyl-6-[4-(3-hydroxyphenyl)-3,4-dimethyl-piperidino]-3-keto-hexanoic acid Formula: C25H38N2O4 MolecularWeight: 430.58022

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1(C)C2=CC(=CC=C2)O)CCC(C3CCCCC3)C(=O)C(C(=O)O)N

Isomeric SMILES

CC1CN(CCC1(C)C2=CC(=CC=C2)O)CCC(C3CCCCC3)C(=O)C(C(=O)O)N

InChI

InChI=1S/C25H38N2O4/c1-17-16-27(14-12-25(17,2)19-9-6-10-20(28)15-19)13-11-21(18-7-4-3-5-8-18)23(29)22(26)24(30)31/h6,9-10,15,17-18,21-22,28H,3-5,7-8,11-14,16,26H2,1-2H3,(H,30,31)