N-(4-methyl-3-nitro-phenyl)-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-(4-methyl-3-nitrophenyl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)-N-(4-methyl-3-nitro-phenyl)butyramide Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCN2C3=CC=CC=C3OC2=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCN2C3=CC=CC=C3OC2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O5/c1-12-8-9-13(11-15(12)21(24)25)19-17(22)7-4-10-20-14-5-2-3-6-16(14)26-18(20)23/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,19,22)