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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H40N4O4/c1-4-6-7-8-9-12-15-35-28(34)23(16-20-17-30-22-14-11-10-13-21(20)22)31-26(33)24-18-36-27(32-24)25(29)19(3)5-2/h10-11,13-14,17-19,23,25,30H,4-9,12,15-16,29H2,1-3H3,(H,31,33)