N-[(3,4-diethoxyphenyl)methyl]-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-nitro-anilino]-N-[(3,4-diethoxyphenyl)methyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[(3,4-diethoxyphenyl)methyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[(3,4-diethoxyphenyl)methyl]acetamide Traditional Name: 2-(N-besyl-3-nitro-anilino)-N-(3,4-diethoxybenzyl)acetamide Formula: C25H27N3O7S MolecularWeight: 513.56278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3)OCC

InChI

InChI=1S/C25H27N3O7S/c1-3-34-23-14-13-19(15-24(23)35-4-2)17-26-25(29)18-27(20-9-8-10-21(16-20)28(30)31)36(32,33)22-11-6-5-7-12-22/h5-16H,3-4,17-18H2,1-2H3,(H,26,29)