3-chloranyl-N'-(2-pyrrolidin-1-ylethanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide

Systemtic Name: 3-chloranyl-N'-(2-pyrrolidin-1-ylethanoyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Openeye Name: 3-chloro-N'-(2-pyrrolidin-1-ylacetyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide CAS Name: 3-chloro-N'-[1-oxo-2-(1-pyrrolidinyl)ethyl]-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide IUPAC Name: 3-chloro-N'-(2-pyrrolidin-1-ylacetyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Traditional Name: 3-chloro-N'-(2-pyrrolidinoacetyl)-6H-benzo[b][1,4]benzoxazepine-5-carbohydrazide Formula: C20H21ClN4O3 MolecularWeight: 400.85874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(=O)NNC(=O)N2CC3=CC=CC=C3OC4=C2C=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)CC(=O)NNC(=O)N2CC3=CC=CC=C3OC4=C2C=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O3/c21-15-7-8-18-16(11-15)25(12-14-5-1-2-6-17(14)28-18)20(27)23-22-19(26)13-24-9-3-4-10-24/h1-2,5-8,11H,3-4,9-10,12-13H2,(H,22,26)(H,23,27)