4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]-5-(2-naphthalen-2-ylethyl)-1,2-oxazole-3-carboxylic acid

Systemtic Name: 4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]-5-(2-naphthalen-2-ylethyl)-1,2-oxazole-3-carboxylic acid Openeye Name: 4-[(2S)-2-amino-3-hydroxy-3-oxo-propyl]-5-[2-(2-naphthyl)ethyl]isoxazole-3-carboxylic acid CAS Name: 4-[(2S)-2-amino-3-hydroxy-3-oxopropyl]-5-[2-(2-naphthalenyl)ethyl]-3-isoxazolecarboxylic acid IUPAC Name: 4-[(2S)-2-amino-3-hydroxy-3-oxopropyl]-5-(2-naphthalen-2-ylethyl)-1,2-oxazole-3-carboxylic acid Traditional Name: 4-[(2S)-2-amino-3-hydroxy-3-keto-propyl]-5-[2-(2-naphthyl)ethyl]isoxazole-3-carboxylic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCC3=C(C(=NO3)C(=O)O)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCC3=C(C(=NO3)C(=O)O)C[C@@H](C(=O)O)N

InChI

InChI=1S/C19H18N2O5/c20-15(18(22)23)10-14-16(26-21-17(14)19(24)25)8-6-11-5-7-12-3-1-2-4-13(12)9-11/h1-5,7,9,15H,6,8,10,20H2,(H,22,23)(H,24,25)/t15-/m0/s1