N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-ethyl-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-ethyl-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-veratryl-butyramide Formula: C22H25N3O7 MolecularWeight: 443.4498

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)OC)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C22H25N3O7/c1-4-23(14-15-7-10-18(30-2)20(12-15)31-3)21(26)6-5-11-24-17-9-8-16(25(28)29)13-19(17)32-22(24)27/h7-10,12-13H,4-6,11,14H2,1-3H3