4-(cyclopropylamino)-3-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(cyclopropylamino)-3-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(cyclopropylamino)-3-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 4-(cyclopropylamino)-3-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(cyclopropylamino)-3-nitro-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-(cyclopropylamino)-3-nitro-N-(2,4,5-trimethoxybenzyl)benzamide Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H23N3O6/c1-27-17-10-19(29-3)18(28-2)9-13(17)11-21-20(24)12-4-7-15(22-14-5-6-14)16(8-12)23(25)26/h4,7-10,14,22H,5-6,11H2,1-3H3,(H,21,24)