methyl 2-(2-azanyl-1-oxidanyl-3-phenyl-propyl)-1,3-benzoxazole-5-carboxylate

Systemtic Name: methyl 2-(2-azanyl-1-oxidanyl-3-phenyl-propyl)-1,3-benzoxazole-5-carboxylate Openeye Name: methyl 2-(2-amino-1-hydroxy-3-phenyl-propyl)-1,3-benzoxazole-5-carboxylate CAS Name: 2-(2-amino-1-hydroxy-3-phenylpropyl)-1,3-benzoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-amino-1-hydroxy-3-phenylpropyl)-1,3-benzoxazole-5-carboxylate Traditional Name: 2-(2-amino-1-hydroxy-3-phenyl-propyl)-1,3-benzoxazole-5-carboxylic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)OC(=N2)C(C(CC3=CC=CC=C3)N)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)OC(=N2)C(C(CC3=CC=CC=C3)N)O

InChI

InChI=1S/C18H18N2O4/c1-23-18(22)12-7-8-15-14(10-12)20-17(24-15)16(21)13(19)9-11-5-3-2-4-6-11/h2-8,10,13,16,21H,9,19H2,1H3