N-(4-methyl-2-oxidanyl-phenyl)-3-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide

Systemtic Name: N-(4-methyl-2-oxidanyl-phenyl)-3-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)propanamide Openeye Name: N-(2-hydroxy-4-methyl-phenyl)-3-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)propanamide CAS Name: N-(2-hydroxy-4-methylphenyl)-3-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)propanamide IUPAC Name: N-(2-hydroxy-4-methylphenyl)-3-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)propanamide Traditional Name: N-(2-hydroxy-4-methyl-phenyl)-3-(2-keto-6-nitro-1,3-benzoxazol-3-yl)propionamide Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)O

InChI

InChI=1S/C17H15N3O6/c1-10-2-4-12(14(21)8-10)18-16(22)6-7-19-13-5-3-11(20(24)25)9-15(13)26-17(19)23/h2-5,8-9,21H,6-7H2,1H3,(H,18,22)