N-[1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxidanylidene-pentan-2-yl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxidanylidene-pentan-2-yl]-4-methyl-3-nitro-benzamide Openeye Name: N-[1-[2-(3,4-dimethoxyphenyl)ethylcarbamoyl]butyl]-4-methyl-3-nitro-benzamide CAS Name: N-[1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxopentan-2-yl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[1-[2-(3,4-dimethoxyphenyl)ethylamino]-1-oxopentan-2-yl]-4-methyl-3-nitrobenzamide Traditional Name: N-[1-(homoveratrylcarbamoyl)butyl]-4-methyl-3-nitro-benzamide Formula: C23H29N3O6 MolecularWeight: 443.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCCC(C(=O)NCCC1=CC(=C(C=C1)OC)OC)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C23H29N3O6/c1-5-6-18(25-22(27)17-9-7-15(2)19(14-17)26(29)30)23(28)24-12-11-16-8-10-20(31-3)21(13-16)32-4/h7-10,13-14,18H,5-6,11-12H2,1-4H3,(H,24,28)(H,25,27)