2-(2-azanylbutanoyl)-5-methyl-1-phenylmethoxycarbonyl-3H-indole-2-carboxylic acid

Systemtic Name: 2-(2-azanylbutanoyl)-5-methyl-1-phenylmethoxycarbonyl-3H-indole-2-carboxylic acid Openeye Name: 2-(2-aminobutanoyl)-1-benzyloxycarbonyl-5-methyl-indoline-2-carboxylic acid CAS Name: 2-(2-amino-1-oxobutyl)-5-methyl-1-phenylmethoxycarbonyl-3H-indole-2-carboxylic acid IUPAC Name: 2-(2-aminobutanoyl)-5-methyl-1-phenylmethoxycarbonyl-3H-indole-2-carboxylic acid Traditional Name: 2-(2-aminobutanoyl)-1-carbobenzoxy-5-methyl-indoline-2-carboxylic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1(CC2=C(N1C(=O)OCC3=CC=CC=C3)C=CC(=C2)C)C(=O)O)N

Isomeric SMILES

CCC(C(=O)C1(CC2=C(N1C(=O)OCC3=CC=CC=C3)C=CC(=C2)C)C(=O)O)N

InChI

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