tert-butyl 4-[(4-butylphenyl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-butylphenyl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-butylphenyl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[(4-butylanilino)-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-butylphenyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(4-butylphenyl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H32N2O3 MolecularWeight: 360.49038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H32N2O3/c1-5-6-7-16-8-10-18(11-9-16)22-19(24)17-12-14-23(15-13-17)20(25)26-21(2,3)4/h8-11,17H,5-7,12-15H2,1-4H3,(H,22,24)