1-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]indoline-2-carboxylic acid CAS Name: 1-[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]indoline-2-carboxylic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1C(CC2=CC=CC=C21)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)N1C(CC2=CC=CC=C21)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-14(2)19(23-22(28)29-13-15-8-4-3-5-9-15)20(25)24-17-11-7-6-10-16(17)12-18(24)21(26)27/h3-11,14,18-19H,12-13H2,1-2H3,(H,23,28)(H,26,27)