5-[2-[[4-(diethylamino)-4-oxidanylidene-butyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid

Systemtic Name: 5-[2-[[4-(diethylamino)-4-oxidanylidene-butyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Openeye Name: 5-[[2-[[4-(diethylamino)-4-oxo-butyl]carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid CAS Name: 5-[[2-[[[[4-(diethylamino)-4-oxobutyl]amino]-oxomethyl]amino]-4-pyridinyl]oxy]-1-indolecarboxylic acid IUPAC Name: 5-[2-[[4-(diethylamino)-4-oxobutyl]carbamoylamino]pyridin-4-yl]oxyindole-1-carboxylic acid Traditional Name: 5-[[2-[[4-(diethylamino)-4-keto-butyl]carbamoylamino]-4-pyridyl]oxy]indole-1-carboxylic acid Formula: C23H27N5O5 MolecularWeight: 453.49098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CCCNC(=O)NC1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C=C3)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)CCCNC(=O)NC1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C=C3)C(=O)O

InChI

InChI=1S/C23H27N5O5/c1-3-27(4-2)21(29)6-5-11-25-22(30)26-20-15-18(9-12-24-20)33-17-7-8-19-16(14-17)10-13-28(19)23(31)32/h7-10,12-15H,3-6,11H2,1-2H3,(H,31,32)(H2,24,25,26,30)