3-[(2-carboxy-4-phenyl-butyl)-ethyl-carbamoyl]-2,3-dihydro-1H-indole-2-carboxylic acid

Systemtic Name: 3-[(2-carboxy-4-phenyl-butyl)-ethyl-carbamoyl]-2,3-dihydro-1H-indole-2-carboxylic acid Openeye Name: 3-[(2-carboxy-4-phenyl-butyl)-ethyl-carbamoyl]indoline-2-carboxylic acid CAS Name: 3-[[(2-carboxy-4-phenylbutyl)-ethylamino]-oxomethyl]-2,3-dihydro-1H-indole-2-carboxylic acid IUPAC Name: 3-[(2-carboxy-4-phenylbutyl)-ethylcarbamoyl]-2,3-dihydro-1H-indole-2-carboxylic acid Traditional Name: 3-[(2-carboxy-4-phenyl-butyl)-ethyl-carbamoyl]indoline-2-carboxylic acid Formula: C23H26N2O5 MolecularWeight: 410.46294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(CCC1=CC=CC=C1)C(=O)O)C(=O)C2C(NC3=CC=CC=C23)C(=O)O

Isomeric SMILES

CCN(CC(CCC1=CC=CC=C1)C(=O)O)C(=O)C2C(NC3=CC=CC=C23)C(=O)O

InChI

InChI=1S/C23H26N2O5/c1-2-25(14-16(22(27)28)13-12-15-8-4-3-5-9-15)21(26)19-17-10-6-7-11-18(17)24-20(19)23(29)30/h3-11,16,19-20,24H,2,12-14H2,1H3,(H,27,28)(H,29,30)