diethyl 2-azanyl-6-[2-oxidanylidene-2-(3-oxidanylpropoxyamino)ethyl]azulene-1,3-dicarboxylate

Systemtic Name: diethyl 2-azanyl-6-[2-oxidanylidene-2-(3-oxidanylpropoxyamino)ethyl]azulene-1,3-dicarboxylate Openeye Name: diethyl 2-amino-6-[2-(3-hydroxypropoxyamino)-2-oxo-ethyl]azulene-1,3-dicarboxylate CAS Name: 2-amino-6-[2-(3-hydroxypropoxyamino)-2-oxoethyl]azulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-amino-6-[2-(3-hydroxypropoxyamino)-2-oxoethyl]azulene-1,3-dicarboxylate Traditional Name: 2-amino-6-[2-(3-hydroxypropoxyamino)-2-keto-ethyl]azulene-1,3-dicarboxylic acid diethyl ester Formula: C21H26N2O7 MolecularWeight: 418.44034

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)NOCCCO

Isomeric SMILES

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1N)C(=O)OCC)CC(=O)NOCCCO

InChI

InChI=1S/C21H26N2O7/c1-3-28-20(26)17-14-8-6-13(12-16(25)23-30-11-5-10-24)7-9-15(14)18(19(17)22)21(27)29-4-2/h6-9,24H,3-5,10-12,22H2,1-2H3,(H,23,25)