4-[1,4-diazepan-1-yl-(3-methylphenyl)methyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[1,4-diazepan-1-yl-(3-methylphenyl)methyl]-N,N-dimethyl-aniline Openeye Name: 4-[1,4-diazepan-1-yl(m-tolyl)methyl]-N,N-dimethyl-aniline CAS Name: 4-[1,4-diazepan-1-yl-(3-methylphenyl)methyl]-N,N-dimethylaniline IUPAC Name: 4-[1,4-diazepan-1-yl-(3-methylphenyl)methyl]-N,N-dimethylaniline Traditional Name: [4-[1,4-diazepan-1-yl(m-tolyl)methyl]phenyl]-dimethyl-amine Formula: C21H29N3 MolecularWeight: 323.47506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCNCC3

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=C(C=C2)N(C)C)N3CCCNCC3

InChI

InChI=1S/C21H29N3/c1-17-6-4-7-19(16-17)21(24-14-5-12-22-13-15-24)18-8-10-20(11-9-18)23(2)3/h4,6-11,16,21-22H,5,12-15H2,1-3H3