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

Systemtic Name: 4-[(4-ethylphenyl)carbamoyl-(3-methylbutyl)amino]piperidine-1-carboxylic acid Openeye Name: 4-[(4-ethylphenyl)carbamoyl-isopentyl-amino]piperidine-1-carboxylic acid CAS Name: 4-[[(4-ethylanilino)-oxomethyl]-(3-methylbutyl)amino]-1-piperidinecarboxylic acid IUPAC Name: 4-[(4-ethylphenyl)carbamoyl-(3-methylbutyl)amino]piperidine-1-carboxylic acid Traditional Name: 4-[(4-ethylphenyl)carbamoyl-isoamyl-amino]piperidine-1-carboxylic acid Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N(CCC(C)C)C2CCN(CC2)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N(CCC(C)C)C2CCN(CC2)C(=O)O

InChI

InChI=1S/C20H31N3O3/c1-4-16-5-7-17(8-6-16)21-19(24)23(14-9-15(2)3)18-10-12-22(13-11-18)20(25)26/h5-8,15,18H,4,9-14H2,1-3H3,(H,21,24)(H,25,26)