4-[1,4-diazepan-1-yl-(3,4-dichlorophenyl)methyl]quinoline

Systemtic Name: 4-[1,4-diazepan-1-yl-(3,4-dichlorophenyl)methyl]quinoline Openeye Name: 4-[1,4-diazepan-1-yl-(3,4-dichlorophenyl)methyl]quinoline CAS Name: 4-[1,4-diazepan-1-yl-(3,4-dichlorophenyl)methyl]quinoline IUPAC Name: 4-[1,4-diazepan-1-yl-(3,4-dichlorophenyl)methyl]quinoline Traditional Name: 4-[1,4-diazepan-1-yl-(3,4-dichlorophenyl)methyl]quinoline Formula: C21H21Cl2N3 MolecularWeight: 386.31754

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC(=C(C=C2)Cl)Cl)C3=CC=NC4=CC=CC=C34

Isomeric SMILES

C1CNCCN(C1)C(C2=CC(=C(C=C2)Cl)Cl)C3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C21H21Cl2N3/c22-18-7-6-15(14-19(18)23)21(26-12-3-9-24-11-13-26)17-8-10-25-20-5-2-1-4-16(17)20/h1-2,4-8,10,14,21,24H,3,9,11-13H2