N-[(E)-2-(1,3-benzodioxol-5-yl)ethylideneamino]-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-amine

Systemtic Name: N-[(E)-2-(1,3-benzodioxol-5-yl)ethylideneamino]-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-amine Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)ethylideneamino]-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-amine CAS Name: N-[(E)-2-(1,3-benzodioxol-5-yl)ethylideneamino]-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-amine IUPAC Name: N-[(E)-2-(1,3-benzodioxol-5-yl)ethylideneamino]-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-amine Traditional Name: [(E)-2-(1,3-benzodioxol-5-yl)ethylideneamino]-(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)amine Formula: C14H18N4O2 MolecularWeight: 274.31832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN=C(NC1)NN=CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCN=C(NC1)N/N=C/CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H18N4O2/c1-2-7-16-14(15-6-1)18-17-8-5-11-3-4-12-13(9-11)20-10-19-12/h3-4,8-9H,1-2,5-7,10H2,(H2,15,16,18)/b17-8+