2-azanyl-N-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-[3-(6-methoxynaphthalen-2-yl)propanoyl]-3-phenyl-propanamide

Systemtic Name: 2-azanyl-N-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-[3-(6-methoxynaphthalen-2-yl)propanoyl]-3-phenyl-propanamide Openeye Name: 2-amino-N-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]-N-[3-(6-methoxy-2-naphthyl)propanoyl]-3-phenyl-propanamide CAS Name: 2-amino-N-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]-N-[3-(6-methoxy-2-naphthalenyl)-1-oxopropyl]-3-phenylpropanamide IUPAC Name: 2-amino-N-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-[3-(6-methoxynaphthalen-2-yl)propanoyl]-3-phenylpropanamide Traditional Name: 2-amino-N-[(3-bromo-2-isoxazolin-5-yl)methyl]-N-[3-(6-methoxy-2-naphthyl)propanoyl]-3-phenyl-propionamide Formula: C27H28BrN3O4 MolecularWeight: 538.43292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)N(CC3CC(=NO3)Br)C(=O)C(CC4=CC=CC=C4)N

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)N(CC3CC(=NO3)Br)C(=O)C(CC4=CC=CC=C4)N

InChI

InChI=1S/C27H28BrN3O4/c1-34-22-11-10-20-13-19(7-9-21(20)15-22)8-12-26(32)31(17-23-16-25(28)30-35-23)27(33)24(29)14-18-5-3-2-4-6-18/h2-7,9-11,13,15,23-24H,8,12,14,16-17,29H2,1H3