ethyl 3-[[3-(1-pentan-2-yl-3,4-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]carbamoylamino]benzoate

Systemtic Name: ethyl 3-[[3-(1-pentan-2-yl-3,4-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]carbamoylamino]benzoate Openeye Name: ethyl 3-[[3-[1-(1-methylbutyl)-3,4-dihydro-2H-pyridin-4-yl]-1H-indol-5-yl]carbamoylamino]benzoate CAS Name: 3-[[oxo-[[3-(1-pentan-2-yl-3,4-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]amino]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[3-(1-pentan-2-yl-3,4-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]carbamoylamino]benzoate Traditional Name: 3-[[3-[1-(1-methylbutyl)-3,4-dihydro-2H-pyridin-4-yl]-1H-indol-5-yl]carbamoylamino]benzoic acid ethyl ester Formula: C28H34N4O3 MolecularWeight: 474.59456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1CCC(C=C1)C2=CNC3=C2C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(=O)OCC

Isomeric SMILES

CCCC(C)N1CCC(C=C1)C2=CNC3=C2C=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(=O)OCC

InChI

InChI=1S/C28H34N4O3/c1-4-7-19(3)32-14-12-20(13-15-32)25-18-29-26-11-10-23(17-24(25)26)31-28(34)30-22-9-6-8-21(16-22)27(33)35-5-2/h6,8-12,14,16-20,29H,4-5,7,13,15H2,1-3H3,(H2,30,31,34)