4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-propan-2-yl-butanamide

Systemtic Name: 4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)-N-propan-2-yl-butanamide Openeye Name: N-isopropyl-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylbutanamide IUPAC Name: 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)-N-propan-2-ylbutanamide Traditional Name: N-isopropyl-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

Isomeric SMILES

CC(C)NC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O

InChI

InChI=1S/C14H17N3O5/c1-9(2)15-13(18)4-3-7-16-11-6-5-10(17(20)21)8-12(11)22-14(16)19/h5-6,8-9H,3-4,7H2,1-2H3,(H,15,18)