propyl 3-[[3-[1-(2-methylpropyl)piperidin-4-yl]-1H-indol-5-yl]carbamoylamino]benzoate

Systemtic Name: propyl 3-[[3-[1-(2-methylpropyl)piperidin-4-yl]-1H-indol-5-yl]carbamoylamino]benzoate Openeye Name: propyl 3-[[3-(1-isobutyl-4-piperidyl)-1H-indol-5-yl]carbamoylamino]benzoate CAS Name: 3-[[[[3-[1-(2-methylpropyl)-4-piperidinyl]-1H-indol-5-yl]amino]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 3-[[3-[1-(2-methylpropyl)piperidin-4-yl]-1H-indol-5-yl]carbamoylamino]benzoate Traditional Name: 3-[[3-(1-isobutyl-4-piperidyl)-1H-indol-5-yl]carbamoylamino]benzoic acid propyl ester Formula: C28H36N4O3 MolecularWeight: 476.61044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=CC=C1)NC(=O)NC2=CC3=C(C=C2)NC=C3C4CCN(CC4)CC(C)C

Isomeric SMILES

CCCOC(=O)C1=CC(=CC=C1)NC(=O)NC2=CC3=C(C=C2)NC=C3C4CCN(CC4)CC(C)C

InChI

InChI=1S/C28H36N4O3/c1-4-14-35-27(33)21-6-5-7-22(15-21)30-28(34)31-23-8-9-26-24(16-23)25(17-29-26)20-10-12-32(13-11-20)18-19(2)3/h5-9,15-17,19-20,29H,4,10-14,18H2,1-3H3,(H2,30,31,34)