2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanedioic acid

Systemtic Name: 2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanedioic acid Openeye Name: 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]butanedioic acid CAS Name: 2-[[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]butanedioic acid IUPAC Name: 2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]butanedioic acid Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]succinic acid Formula: C17H22N2O7 MolecularWeight: 366.36578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H22N2O7/c1-10(2)14(15(22)18-12(16(23)24)8-13(20)21)19-17(25)26-9-11-6-4-3-5-7-11/h3-7,10,12,14H,8-9H2,1-2H3,(H,18,22)(H,19,25)(H,20,21)(H,23,24)