octyl 2-[[2-(1-azanyl-3-methyl-butyl)-1,3-oxazol-4-yl]carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: octyl 2-[[2-(1-azanyl-3-methyl-butyl)-1,3-oxazol-4-yl]carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: octyl 2-[[2-(1-amino-3-methyl-butyl)oxazole-4-carbonyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[[2-(1-amino-3-methylbutyl)-4-oxazolyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid octyl ester IUPAC Name: octyl 2-[[2-(1-amino-3-methylbutyl)-1,3-oxazole-4-carbonyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[2-(1-amino-3-methyl-butyl)oxazole-4-carbonyl]amino]-3-(1H-indol-3-yl)propionic acid octyl ester Formula: C28H40N4O4 MolecularWeight: 496.6416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=COC(=N3)C(CC(C)C)N

Isomeric SMILES

CCCCCCCCOC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=COC(=N3)C(CC(C)C)N

InChI

InChI=1S/C28H40N4O4/c1-4-5-6-7-8-11-14-35-28(34)24(16-20-17-30-23-13-10-9-12-21(20)23)31-26(33)25-18-36-27(32-25)22(29)15-19(2)3/h9-10,12-13,17-19,22,24,30H,4-8,11,14-16,29H2,1-3H3,(H,31,33)