(phenylmethyl) N-[4,5-bis(azanyl)-5-oxidanylidene-pentanoyl]-N-[(3-methoxy-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate

Systemtic Name: (phenylmethyl) N-[4,5-bis(azanyl)-5-oxidanylidene-pentanoyl]-N-[(3-methoxy-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate Openeye Name: benzyl N-(4,5-diamino-5-oxo-pentanoyl)-N-[(3-methoxy-4,5-dihydroisoxazol-5-yl)methyl]carbamate CAS Name: N-(4,5-diamino-1,5-dioxopentyl)-N-[(3-methoxy-4,5-dihydroisoxazol-5-yl)methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(4,5-diamino-5-oxopentanoyl)-N-[(3-methoxy-4,5-dihydro-1,2-oxazol-5-yl)methyl]carbamate Traditional Name: N-(4,5-diamino-5-keto-pentanoyl)-N-[(3-methoxy-2-isoxazolin-5-yl)methyl]carbamic acid benzyl ester Formula: C18H24N4O6 MolecularWeight: 392.40636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NOC(C1)CN(C(=O)CCC(C(=O)N)N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC1=NOC(C1)CN(C(=O)CCC(C(=O)N)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H24N4O6/c1-26-15-9-13(28-21-15)10-22(16(23)8-7-14(19)17(20)24)18(25)27-11-12-5-3-2-4-6-12/h2-6,13-14H,7-11,19H2,1H3,(H2,20,24)