5-(2,3-dihydro-1H-indol-5-ylcarbonylamino)-2-(dimethylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(2,3-dihydro-1H-indol-5-ylcarbonylamino)-2-(dimethylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 2-(dimethylamino)-5-(indoline-5-carbonylamino)-5-oxo-pentanoic acid CAS Name: 5-[[2,3-dihydro-1H-indol-5-yl(oxo)methyl]amino]-2-(dimethylamino)-5-oxopentanoic acid IUPAC Name: 5-(2,3-dihydro-1H-indole-5-carbonylamino)-2-(dimethylamino)-5-oxopentanoic acid Traditional Name: 2-(dimethylamino)-5-(indoline-5-carbonylamino)-5-keto-valeric acid Formula: C16H21N3O4 MolecularWeight: 319.35564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CCC(=O)NC(=O)C1=CC2=C(C=C1)NCC2)C(=O)O

Isomeric SMILES

CN(C)C(CCC(=O)NC(=O)C1=CC2=C(C=C1)NCC2)C(=O)O

InChI

InChI=1S/C16H21N3O4/c1-19(2)13(16(22)23)5-6-14(20)18-15(21)11-3-4-12-10(9-11)7-8-17-12/h3-4,9,13,17H,5-8H2,1-2H3,(H,22,23)(H,18,20,21)