N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-hydroxyethylamino)-3-nitro-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-hydroxyethylamino)-3-nitro-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-hydroxyethylamino)-3-nitro-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-hydroxyethylamino)-3-nitrobenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-hydroxyethylamino)-3-nitrobenzamide Traditional Name: N-homoveratryl-4-(2-hydroxyethylamino)-3-nitro-benzamide Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O6/c1-27-17-6-3-13(11-18(17)28-2)7-8-21-19(24)14-4-5-15(20-9-10-23)16(12-14)22(25)26/h3-6,11-12,20,23H,7-10H2,1-2H3,(H,21,24)