(phenylmethyl) 2-aminocarbonyl-2-azanyl-1-butyl-4-methyl-piperidine-3-carboxylate

Systemtic Name: (phenylmethyl) 2-aminocarbonyl-2-azanyl-1-butyl-4-methyl-piperidine-3-carboxylate Openeye Name: benzyl 2-amino-1-butyl-2-carbamoyl-4-methyl-piperidine-3-carboxylate CAS Name: 2-amino-1-butyl-2-carbamoyl-4-methyl-3-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-1-butyl-2-carbamoyl-4-methylpiperidine-3-carboxylate Traditional Name: 2-amino-1-butyl-2-carbamoyl-4-methyl-nipecotic acid benzyl ester Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(C(C1(C(=O)N)N)C(=O)OCC2=CC=CC=C2)C

Isomeric SMILES

CCCCN1CCC(C(C1(C(=O)N)N)C(=O)OCC2=CC=CC=C2)C

InChI

InChI=1S/C19H29N3O3/c1-3-4-11-22-12-10-14(2)16(19(22,21)18(20)24)17(23)25-13-15-8-6-5-7-9-15/h5-9,14,16H,3-4,10-13,21H2,1-2H3,(H2,20,24)