1-[2-[3-(hydroxymethyl)piperidin-1-yl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[2-[3-(hydroxymethyl)piperidin-1-yl]-2-oxidanylidene-ethyl]cycloheptane-1-carboxylic acid Openeye Name: 1-[2-[3-(hydroxymethyl)-1-piperidyl]-2-oxo-ethyl]cycloheptanecarboxylic acid CAS Name: 1-[2-[3-(hydroxymethyl)-1-piperidinyl]-2-oxoethyl]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[2-[3-(hydroxymethyl)piperidin-1-yl]-2-oxoethyl]cycloheptane-1-carboxylic acid Traditional Name: 1-[2-keto-2-(3-methylolpiperidino)ethyl]cycloheptanecarboxylic acid Formula: C16H27NO4 MolecularWeight: 297.38988

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(CC(=O)N2CCCC(C2)CO)C(=O)O

Isomeric SMILES

C1CCCC(CC1)(CC(=O)N2CCCC(C2)CO)C(=O)O

InChI

InChI=1S/C16H27NO4/c18-12-13-6-5-9-17(11-13)14(19)10-16(15(20)21)7-3-1-2-4-8-16/h13,18H,1-12H2,(H,20,21)