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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-nitro-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-nitro-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-nitrobenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-nitrobenzamide Traditional Name: N-homoveratryl-3-nitro-benzamide Formula: C17H18N2O5 MolecularWeight: 330.33522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5/c1-23-15-7-6-12(10-16(15)24-2)8-9-18-17(20)13-4-3-5-14(11-13)19(21)22/h3-7,10-11H,8-9H2,1-2H3,(H,18,20)