N-(3,4-dipropoxyphenyl)-4-(methylamino)-3-nitro-benzamide

Systemtic Name: N-(3,4-dipropoxyphenyl)-4-(methylamino)-3-nitro-benzamide Openeye Name: N-(3,4-dipropoxyphenyl)-4-(methylamino)-3-nitro-benzamide CAS Name: N-(3,4-dipropoxyphenyl)-4-(methylamino)-3-nitrobenzamide IUPAC Name: N-(3,4-dipropoxyphenyl)-4-(methylamino)-3-nitrobenzamide Traditional Name: N-(3,4-dipropoxyphenyl)-4-(methylamino)-3-nitro-benzamide Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-])OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-])OCCC

InChI

InChI=1S/C20H25N3O5/c1-4-10-27-18-9-7-15(13-19(18)28-11-5-2)22-20(24)14-6-8-16(21-3)17(12-14)23(25)26/h6-9,12-13,21H,4-5,10-11H2,1-3H3,(H,22,24)