4-[2-[1-(2-methylpropanoyl)piperidin-3-yl]oxyphenyl]piperazine-1-carboxylic acid

Systemtic Name: 4-[2-[1-(2-methylpropanoyl)piperidin-3-yl]oxyphenyl]piperazine-1-carboxylic acid Openeye Name: 4-[2-[[1-(2-methylpropanoyl)-3-piperidyl]oxy]phenyl]piperazine-1-carboxylic acid CAS Name: 4-[2-[[1-(2-methyl-1-oxopropyl)-3-piperidinyl]oxy]phenyl]-1-piperazinecarboxylic acid IUPAC Name: 4-[2-[1-(2-methylpropanoyl)piperidin-3-yl]oxyphenyl]piperazine-1-carboxylic acid Traditional Name: 4-[2-[(1-isobutyryl-3-piperidyl)oxy]phenyl]piperazine-1-carboxylic acid Formula: C20H29N3O4 MolecularWeight: 375.46196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)OC2=CC=CC=C2N3CCN(CC3)C(=O)O

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)OC2=CC=CC=C2N3CCN(CC3)C(=O)O

InChI

InChI=1S/C20H29N3O4/c1-15(2)19(24)23-9-5-6-16(14-23)27-18-8-4-3-7-17(18)21-10-12-22(13-11-21)20(25)26/h3-4,7-8,15-16H,5-6,9-14H2,1-2H3,(H,25,26)