N4-(azepan-4-yl)-2-methyl-benzene-1,4-diamine

Systemtic Name: N4-(azepan-4-yl)-2-methyl-benzene-1,4-diamine Openeye Name: N4-(azepan-4-yl)-2-methyl-benzene-1,4-diamine CAS Name: N4-(4-azepanyl)-2-methylbenzene-1,4-diamine IUPAC Name: 4-N-(azepan-4-yl)-2-methylbenzene-1,4-diamine Traditional Name: (4-amino-3-methyl-phenyl)-(azepan-4-yl)amine Formula: C13H21N3 MolecularWeight: 219.32594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2CCCNCC2)N

Isomeric SMILES

CC1=C(C=CC(=C1)NC2CCCNCC2)N

InChI

InChI=1S/C13H21N3/c1-10-9-12(4-5-13(10)14)16-11-3-2-7-15-8-6-11/h4-5,9,11,15-16H,2-3,6-8,14H2,1H3