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

Systemtic Name: N4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-benzene-1,4-diamine Openeye Name: N4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-benzene-1,4-diamine CAS Name: N4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylbenzene-1,4-diamine IUPAC Name: 4-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylbenzene-1,4-diamine Traditional Name: (4-amino-3-methyl-phenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)amine Formula: C16H18N2O2 MolecularWeight: 270.32632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=CC3=C(C=C2)OCCCO3)N

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=CC3=C(C=C2)OCCCO3)N

InChI

InChI=1S/C16H18N2O2/c1-11-9-12(3-5-14(11)17)18-13-4-6-15-16(10-13)20-8-2-7-19-15/h3-6,9-10,18H,2,7-8,17H2,1H3