(phenylmethyl) 2-[[2-(1-azanylpentyl)-1,3-oxazol-4-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) 2-[[2-(1-azanylpentyl)-1,3-oxazol-4-yl]carbonylamino]-3-methyl-butanoate Openeye Name: benzyl 2-[[2-(1-aminopentyl)oxazole-4-carbonyl]amino]-3-methyl-butanoate CAS Name: 2-[[[2-(1-aminopentyl)-4-oxazolyl]-oxomethyl]amino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-(1-aminopentyl)-1,3-oxazole-4-carbonyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-(1-aminopentyl)oxazole-4-carbonyl]amino]-3-methyl-butyric acid benzyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=NC(=CO1)C(=O)NC(C(C)C)C(=O)OCC2=CC=CC=C2)N

Isomeric SMILES

CCCCC(C1=NC(=CO1)C(=O)NC(C(C)C)C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C21H29N3O4/c1-4-5-11-16(22)20-23-17(13-27-20)19(25)24-18(14(2)3)21(26)28-12-15-9-7-6-8-10-15/h6-10,13-14,16,18H,4-5,11-12,22H2,1-3H3,(H,24,25)