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

Systemtic Name: diethyl 2-azanyl-6-[2-oxidanylidene-2-(3-piperidin-1-ylpropoxyamino)ethyl]azulene-1,3-dicarboxylate Openeye Name: diethyl 2-amino-6-[2-oxo-2-[3-(1-piperidyl)propoxyamino]ethyl]azulene-1,3-dicarboxylate CAS Name: 2-amino-6-[2-oxo-2-[3-(1-piperidinyl)propoxyamino]ethyl]azulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-amino-6-[2-oxo-2-(3-piperidin-1-ylpropoxyamino)ethyl]azulene-1,3-dicarboxylate Traditional Name: 2-amino-6-[2-keto-2-(3-piperidinopropoxyamino)ethyl]azulene-1,3-dicarboxylic acid diethyl ester Formula: C26H35N3O6 MolecularWeight: 485.5726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1N)C(=O)OCC)CC(=O)NOCCCN3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C2C=CC(=CC=C2C(=C1N)C(=O)OCC)CC(=O)NOCCCN3CCCCC3

InChI

InChI=1S/C26H35N3O6/c1-3-33-25(31)22-19-11-9-18(10-12-20(19)23(24(22)27)26(32)34-4-2)17-21(30)28-35-16-8-15-29-13-6-5-7-14-29/h9-12H,3-8,13-17,27H2,1-2H3,(H,28,30)