N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-N'-(4-nitrophenyl)ethane-1,2-diamine

Systemtic Name: N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-N'-(4-nitrophenyl)ethane-1,2-diamine Openeye Name: N-[[3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]-N'-(4-nitrophenyl)ethane-1,2-diamine CAS Name: N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-N'-(4-nitrophenyl)ethane-1,2-diamine IUPAC Name: N-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-N'-(4-nitrophenyl)ethane-1,2-diamine Traditional Name: [3-ethoxy-4-(2-thenyloxy)benzyl]-[2-(4-nitroanilino)ethyl]amine Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNCCNC2=CC=C(C=C2)[N+](=O)[O-])OCC3=CC=CS3

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNCCNC2=CC=C(C=C2)[N+](=O)[O-])OCC3=CC=CS3

InChI

InChI=1S/C22H25N3O4S/c1-2-28-22-14-17(5-10-21(22)29-16-20-4-3-13-30-20)15-23-11-12-24-18-6-8-19(9-7-18)25(26)27/h3-10,13-14,23-24H,2,11-12,15-16H2,1H3