N4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3,4-diamine

Systemtic Name: N4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3,4-diamine Openeye Name: N4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3,4-diamine CAS Name: N4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3,4-diamine IUPAC Name: 4-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyridine-3,4-diamine Traditional Name: (3-amino-4-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=NC=C3)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC3=C(C=NC=C3)N)OC1

InChI

InChI=1S/C14H15N3O2/c15-11-9-16-5-4-12(11)17-10-2-3-13-14(8-10)19-7-1-6-18-13/h2-5,8-9H,1,6-7,15H2,(H,16,17)