4-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]piperidine-1-carboxylic acid

Systemtic Name: 4-[3-methylbutyl-(4-phenylmethoxyphenyl)amino]piperidine-1-carboxylic acid Openeye Name: 4-(4-benzyloxy-N-isopentyl-anilino)piperidine-1-carboxylic acid CAS Name: 4-[N-(3-methylbutyl)-4-phenylmethoxyanilino]-1-piperidinecarboxylic acid IUPAC Name: 4-[N-(3-methylbutyl)-4-phenylmethoxyanilino]piperidine-1-carboxylic acid Traditional Name: 4-(4-benzoxy-N-isoamyl-anilino)piperidine-1-carboxylic acid Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(C1CCN(CC1)C(=O)O)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)CCN(C1CCN(CC1)C(=O)O)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C24H32N2O3/c1-19(2)12-17-26(22-13-15-25(16-14-22)24(27)28)21-8-10-23(11-9-21)29-18-20-6-4-3-5-7-20/h3-11,19,22H,12-18H2,1-2H3,(H,27,28)