1-[(3,4-dichlorophenyl)methyl]-4-(2-morpholin-4-ylethanoylamino)indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-4-(2-morpholin-4-ylethanoylamino)indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(2-morpholinoacetyl)amino]indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-4-[[2-(4-morpholinyl)-1-oxoethyl]amino]-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-4-[(2-morpholin-4-ylacetyl)amino]indole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-4-[(2-morpholinoacetyl)amino]indole-2-carboxylic acid Formula: C22H21Cl2N3O4 MolecularWeight: 462.32584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(=O)NC2=CC=CC3=C2C=C(N3CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

Isomeric SMILES

C1COCCN1CC(=O)NC2=CC=CC3=C2C=C(N3CC4=CC(=C(C=C4)Cl)Cl)C(=O)O

InChI

InChI=1S/C22H21Cl2N3O4/c23-16-5-4-14(10-17(16)24)12-27-19-3-1-2-18(15(19)11-20(27)22(29)30)25-21(28)13-26-6-8-31-9-7-26/h1-5,10-11H,6-9,12-13H2,(H,25,28)(H,29,30)