3-chloranyl-N,N-dimethyl-4-[[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methyl]aniline

Systemtic Name: 3-chloranyl-N,N-dimethyl-4-[[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methyl]aniline Openeye Name: 3-chloro-N,N-dimethyl-4-[[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methyl]aniline CAS Name: 3-chloro-N,N-dimethyl-4-[[4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]methyl]aniline IUPAC Name: 3-chloro-N,N-dimethyl-4-[[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]methyl]aniline Traditional Name: [3-chloro-4-[[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]methyl]phenyl]-dimethyl-amine Formula: C20H27ClN4 MolecularWeight: 358.90818

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1)CN2CCCN(CC2)CC3=CN=CC=C3)Cl

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)CN2CCCN(CC2)CC3=CN=CC=C3)Cl

InChI

InChI=1S/C20H27ClN4/c1-23(2)19-7-6-18(20(21)13-19)16-25-10-4-9-24(11-12-25)15-17-5-3-8-22-14-17/h3,5-8,13-14H,4,9-12,15-16H2,1-2H3