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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C(C(C2=CC=CC=C21)C)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)N1C(C(C2=CC=CC=C21)C)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-3-17(23-22(28)29-13-15-9-5-4-6-10-15)20(25)24-18-12-8-7-11-16(18)14(2)19(24)21(26)27/h4-12,14,17,19H,3,13H2,1-2H3,(H,23,28)(H,26,27)