butyl 2-(1-adamantylcarbamoylamino)-3-(1H-indol-3-yl)propanoate

Systemtic Name: butyl 2-(1-adamantylcarbamoylamino)-3-(1H-indol-3-yl)propanoate Openeye Name: butyl 2-(1-adamantylcarbamoylamino)-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[(1-adamantylamino)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid butyl ester IUPAC Name: butyl 2-(1-adamantylcarbamoylamino)-3-(1H-indol-3-yl)propanoate Traditional Name: 2-(1-adamantylcarbamoylamino)-3-(1H-indol-3-yl)propionic acid butyl ester Formula: C26H35N3O3 MolecularWeight: 437.5744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H35N3O3/c1-2-3-8-32-24(30)23(12-20-16-27-22-7-5-4-6-21(20)22)28-25(31)29-26-13-17-9-18(14-26)11-19(10-17)15-26/h4-7,16-19,23,27H,2-3,8-15H2,1H3,(H2,28,29,31)