3-[1,4-diazepan-1-yl-(2,4-dichlorophenyl)methyl]quinoline

Systemtic Name: 3-[1,4-diazepan-1-yl-(2,4-dichlorophenyl)methyl]quinoline Openeye Name: 3-[1,4-diazepan-1-yl-(2,4-dichlorophenyl)methyl]quinoline CAS Name: 3-[1,4-diazepan-1-yl-(2,4-dichlorophenyl)methyl]quinoline IUPAC Name: 3-[1,4-diazepan-1-yl-(2,4-dichlorophenyl)methyl]quinoline Traditional Name: 3-[1,4-diazepan-1-yl-(2,4-dichlorophenyl)methyl]quinoline Formula: C21H21Cl2N3 MolecularWeight: 386.31754

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=C(C=C(C=C2)Cl)Cl)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1CNCCN(C1)C(C2=C(C=C(C=C2)Cl)Cl)C3=CC4=CC=CC=C4N=C3

InChI

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