N2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-2,3-diamine

Systemtic Name: N2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-2,3-diamine Openeye Name: N2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-2,3-diamine CAS Name: N2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-2,3-diamine IUPAC Name: 2-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-2,3-diamine Traditional Name: (3-amino-2-pyridyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)amine Formula: C14H15N3O2 MolecularWeight: 257.2878

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC3=C(C=CC=N3)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC3=C(C=CC=N3)N)OC1

InChI

InChI=1S/C14H15N3O2/c15-11-3-1-6-16-14(11)17-10-4-5-12-13(9-10)19-8-2-7-18-12/h1,3-6,9H,2,7-8,15H2,(H,16,17)