3-[3-methyl-4-[[2-(3-oxidanylidenepropyl)phenyl]amino]piperidin-1-yl]propanoic acid

Systemtic Name: 3-[3-methyl-4-[[2-(3-oxidanylidenepropyl)phenyl]amino]piperidin-1-yl]propanoic acid Openeye Name: 3-[3-methyl-4-[2-(3-oxopropyl)anilino]-1-piperidyl]propanoic acid CAS Name: 3-[3-methyl-4-[2-(3-oxopropyl)anilino]-1-piperidinyl]propanoic acid IUPAC Name: 3-[3-methyl-4-[2-(3-oxopropyl)anilino]piperidin-1-yl]propanoic acid Traditional Name: 3-[4-[2-(3-ketopropyl)anilino]-3-methyl-piperidino]propionic acid Formula: C18H26N2O3 MolecularWeight: 318.41064

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NC2=CC=CC=C2CCC=O)CCC(=O)O

Isomeric SMILES

CC1CN(CCC1NC2=CC=CC=C2CCC=O)CCC(=O)O

InChI

InChI=1S/C18H26N2O3/c1-14-13-20(11-9-18(22)23)10-8-16(14)19-17-7-3-2-5-15(17)6-4-12-21/h2-3,5,7,12,14,16,19H,4,6,8-11,13H2,1H3,(H,22,23)