2-chloranyl-N-(2,2-dimethoxyethyl)-11H-benzo[b][1,4]benzodiazepin-6-amine

Systemtic Name: 2-chloranyl-N-(2,2-dimethoxyethyl)-11H-benzo[b][1,4]benzodiazepin-6-amine Openeye Name: 2-chloro-N-(2,2-dimethoxyethyl)-11H-benzo[b][1,4]benzodiazepin-6-amine CAS Name: 2-chloro-N-(2,2-dimethoxyethyl)-11H-benzo[b][1,4]benzodiazepin-6-amine IUPAC Name: 2-chloro-N-(2,2-dimethoxyethyl)-11H-benzo[b][1,4]benzodiazepin-6-amine Traditional Name: (2-chloro-11H-benzo[b][1,4]benzodiazepin-6-yl)-(2,2-dimethoxyethyl)amine Formula: C17H18ClN3O2 MolecularWeight: 331.79672

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC1=NC2=C(C=C(C=C2)Cl)NC3=CC=CC=C31)OC

Isomeric SMILES

COC(CNC1=NC2=C(C=C(C=C2)Cl)NC3=CC=CC=C31)OC

InChI

InChI=1S/C17H18ClN3O2/c1-22-16(23-2)10-19-17-12-5-3-4-6-13(12)20-15-9-11(18)7-8-14(15)21-17/h3-9,16,20H,10H2,1-2H3,(H,19,21)