3-methyl-2-[(1-phenylmethoxycarbonylpiperidin-4-yl)carbonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(1-phenylmethoxycarbonylpiperidin-4-yl)carbonylamino]butanoic acid Openeye Name: 2-[(1-benzyloxycarbonylpiperidine-4-carbonyl)amino]-3-methyl-butanoic acid CAS Name: 3-methyl-2-[[oxo-(1-phenylmethoxycarbonyl-4-piperidinyl)methyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[(1-phenylmethoxycarbonylpiperidine-4-carbonyl)amino]butanoic acid Traditional Name: 2-[(1-carbobenzoxyisonipecotoyl)amino]-3-methyl-butyric acid Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1CCN(CC1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1CCN(CC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H26N2O5/c1-13(2)16(18(23)24)20-17(22)15-8-10-21(11-9-15)19(25)26-12-14-6-4-3-5-7-14/h3-7,13,15-16H,8-12H2,1-2H3,(H,20,22)(H,23,24)