N-[2-(3,4-dimethoxyphenyl)-2-prop-2-enyl-pent-4-enyl]-4-nitro-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-2-prop-2-enyl-pent-4-enyl]-4-nitro-benzamide Openeye Name: N-[2-allyl-2-(3,4-dimethoxyphenyl)pent-4-enyl]-4-nitro-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-2-prop-2-enylpent-4-enyl]-4-nitrobenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-2-prop-2-enylpent-4-enyl]-4-nitrobenzamide Traditional Name: N-[2-allyl-2-(3,4-dimethoxyphenyl)pent-4-enyl]-4-nitro-benzamide Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC=C)(CC=C)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC=C)(CC=C)CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C23H26N2O5/c1-5-13-23(14-6-2,18-9-12-20(29-3)21(15-18)30-4)16-24-22(26)17-7-10-19(11-8-17)25(27)28/h5-12,15H,1-2,13-14,16H2,3-4H3,(H,24,26)