N-azanyl-2-[2-azanyl-1,3-bis(ethoxycarbonyl)azulen-6-yl]-N-ethoxy-1-oxidanylidene-ethanamine oxide

Systemtic Name: N-azanyl-2-[2-azanyl-1,3-bis(ethoxycarbonyl)azulen-6-yl]-N-ethoxy-1-oxidanylidene-ethanamine oxide Openeye Name: N-amino-2-[2-amino-1,3-bis(ethoxycarbonyl)azulen-6-yl]-N-ethoxy-1-oxo-ethanamine oxide CAS Name: N-amino-2-[2-amino-1,3-bis(ethoxycarbonyl)-6-azulenyl]-N-ethoxy-1-oxoethanamine oxide IUPAC Name: N-amino-2-[2-amino-1,3-bis(ethoxycarbonyl)azulen-6-yl]-N-ethoxy-1-oxoethanamine oxide Traditional Name: N-amino-2-(2-amino-1,3-dicarbethoxy-azulen-6-yl)-N-ethoxy-1-keto-ethanamine oxide Formula: C20H25N3O7 MolecularWeight: 419.4284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1N)C(=O)OCC)CC(=O)[N+](N)([O-])OCC

Isomeric SMILES

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1N)C(=O)OCC)CC(=O)[N+](N)([O-])OCC

InChI

InChI=1S/C20H25N3O7/c1-4-28-19(25)16-13-9-7-12(11-15(24)23(22,27)30-6-3)8-10-14(13)17(18(16)21)20(26)29-5-2/h7-10H,4-6,11,21-22H2,1-3H3