(phenylmethyl) N-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-[2-(naphthalen-1-ylamino)propanoyl]carbamate

Systemtic Name: (phenylmethyl) N-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-[2-(naphthalen-1-ylamino)propanoyl]carbamate Openeye Name: benzyl N-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]-N-[2-(1-naphthylamino)propanoyl]carbamate CAS Name: N-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]-N-[2-(1-naphthalenylamino)-1-oxopropyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-[2-(naphthalen-1-ylamino)propanoyl]carbamate Traditional Name: N-[(3-bromo-2-isoxazolin-5-yl)methyl]-N-[2-(1-naphthylamino)propanoyl]carbamic acid benzyl ester Formula: C25H24BrN3O4 MolecularWeight: 510.37976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1CC(=NO1)Br)C(=O)OCC2=CC=CC=C2)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)N(CC1CC(=NO1)Br)C(=O)OCC2=CC=CC=C2)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H24BrN3O4/c1-17(27-22-13-7-11-19-10-5-6-12-21(19)22)24(30)29(15-20-14-23(26)28-33-20)25(31)32-16-18-8-3-2-4-9-18/h2-13,17,20,27H,14-16H2,1H3