N-[[4-(3,4-dimethoxyphenyl)oxan-4-yl]methyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[[4-(3,4-dimethoxyphenyl)oxan-4-yl]methyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[[4-(3,4-dimethoxyphenyl)tetrahydropyran-4-yl]methyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[[4-(3,4-dimethoxyphenyl)-4-oxanyl]methyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[[4-(3,4-dimethoxyphenyl)oxan-4-yl]methyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[[4-(3,4-dimethoxyphenyl)tetrahydropyran-4-yl]methyl]-4-methoxy-3-nitro-benzamide Formula: C22H26N2O7 MolecularWeight: 430.45104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2(CCOCC2)C3=CC(=C(C=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2(CCOCC2)C3=CC(=C(C=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H26N2O7/c1-28-18-6-4-15(12-17(18)24(26)27)21(25)23-14-22(8-10-31-11-9-22)16-5-7-19(29-2)20(13-16)30-3/h4-7,12-13H,8-11,14H2,1-3H3,(H,23,25)