5-[1-[4-(3-hydroxyphenyl)-4-methyl-piperidin-1-yl]butyl-(2-methylpropyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[1-[4-(3-hydroxyphenyl)-4-methyl-piperidin-1-yl]butyl-(2-methylpropyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[1-[4-(3-hydroxyphenyl)-4-methyl-1-piperidyl]butyl-isobutyl-amino]-5-oxo-pentanoic acid CAS Name: 5-[1-[4-(3-hydroxyphenyl)-4-methyl-1-piperidinyl]butyl-(2-methylpropyl)amino]-5-oxopentanoic acid IUPAC Name: 5-[1-[4-(3-hydroxyphenyl)-4-methylpiperidin-1-yl]butyl-(2-methylpropyl)amino]-5-oxopentanoic acid Traditional Name: 5-[1-[4-(3-hydroxyphenyl)-4-methyl-piperidino]butyl-isobutyl-amino]-5-keto-valeric acid Formula: C25H40N2O4 MolecularWeight: 432.5961

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(N1CCC(CC1)(C)C2=CC(=CC=C2)O)N(CC(C)C)C(=O)CCCC(=O)O

Isomeric SMILES

CCCC(N1CCC(CC1)(C)C2=CC(=CC=C2)O)N(CC(C)C)C(=O)CCCC(=O)O

InChI

InChI=1S/C25H40N2O4/c1-5-8-22(27(18-19(2)3)23(29)11-7-12-24(30)31)26-15-13-25(4,14-16-26)20-9-6-10-21(28)17-20/h6,9-10,17,19,22,28H,5,7-8,11-16,18H2,1-4H3,(H,30,31)