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

Systemtic Name: octyl 2-[[2-(1-azanylethyl)-1,3-oxazol-4-yl]carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: octyl 2-[[2-(1-aminoethyl)oxazole-4-carbonyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[[2-(1-aminoethyl)-4-oxazolyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid octyl ester IUPAC Name: octyl 2-[[2-(1-aminoethyl)-1,3-oxazole-4-carbonyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[2-(1-aminoethyl)oxazole-4-carbonyl]amino]-3-(1H-indol-3-yl)propionic acid octyl ester Formula: C25H34N4O4 MolecularWeight: 454.56186

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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)N

Isomeric SMILES

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

InChI

InChI=1S/C25H34N4O4/c1-3-4-5-6-7-10-13-32-25(31)21(14-18-15-27-20-12-9-8-11-19(18)20)28-23(30)22-16-33-24(29-22)17(2)26/h8-9,11-12,15-17,21,27H,3-7,10,13-14,26H2,1-2H3,(H,28,30)