methyl (2S)-2-[[3-(naphthalen-1-ylmethyl)-1,2-oxazol-5-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[3-(naphthalen-1-ylmethyl)-1,2-oxazol-5-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[3-(1-naphthylmethyl)isoxazole-5-carbonyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[[3-(1-naphthalenylmethyl)-5-isoxazolyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[3-(naphthalen-1-ylmethyl)-1,2-oxazole-5-carbonyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[3-(1-naphthylmethyl)isoxazole-5-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2=CC(=NO2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC(=NO2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H22N2O4/c1-30-25(29)22(14-17-8-3-2-4-9-17)26-24(28)23-16-20(27-31-23)15-19-12-7-11-18-10-5-6-13-21(18)19/h2-13,16,22H,14-15H2,1H3,(H,26,28)/t22-/m0/s1