2-(2-azanylethanoyl)-3-tert-butyl-2-[(4-methylpiperidin-2-yl)-phenylmethoxycarbonyl-amino]butanedioic acid

Systemtic Name: 2-(2-azanylethanoyl)-3-tert-butyl-2-[(4-methylpiperidin-2-yl)-phenylmethoxycarbonyl-amino]butanedioic acid Openeye Name: 2-(2-aminoacetyl)-2-[benzyloxycarbonyl-(4-methyl-2-piperidyl)amino]-3-tert-butyl-butanedioic acid CAS Name: 2-(2-amino-1-oxoethyl)-3-tert-butyl-2-[(4-methyl-2-piperidinyl)-phenylmethoxycarbonylamino]butanedioic acid IUPAC Name: 2-(2-aminoacetyl)-3-tert-butyl-2-[(4-methylpiperidin-2-yl)-phenylmethoxycarbonylamino]butanedioic acid Traditional Name: 3-tert-butyl-2-[carbobenzoxy-(4-methyl-2-piperidyl)amino]-2-glycyl-succinic acid Formula: C24H35N3O7 MolecularWeight: 477.5506

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCNC(C1)N(C(=O)OCC2=CC=CC=C2)C(C(C(=O)O)C(C)(C)C)(C(=O)CN)C(=O)O

Isomeric SMILES

CC1CCNC(C1)N(C(=O)OCC2=CC=CC=C2)C(C(C(=O)O)C(C)(C)C)(C(=O)CN)C(=O)O

InChI

InChI=1S/C24H35N3O7/c1-15-10-11-26-18(12-15)27(22(33)34-14-16-8-6-5-7-9-16)24(21(31)32,17(28)13-25)19(20(29)30)23(2,3)4/h5-9,15,18-19,26H,10-14,25H2,1-4H3,(H,29,30)(H,31,32)