3-[(5-chloranyl-2-ethoxy-phenyl)-(1,4-diazepan-1-yl)methyl]quinoline

Systemtic Name: 3-[(5-chloranyl-2-ethoxy-phenyl)-(1,4-diazepan-1-yl)methyl]quinoline Openeye Name: 3-[(5-chloro-2-ethoxy-phenyl)-(1,4-diazepan-1-yl)methyl]quinoline CAS Name: 3-[(5-chloro-2-ethoxyphenyl)-(1,4-diazepan-1-yl)methyl]quinoline IUPAC Name: 3-[(5-chloro-2-ethoxyphenyl)-(1,4-diazepan-1-yl)methyl]quinoline Traditional Name: 3-[(5-chloro-2-ethoxy-phenyl)-(1,4-diazepan-1-yl)methyl]quinoline Formula: C23H26ClN3O MolecularWeight: 395.92504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=CC3=CC=CC=C3N=C2)N4CCCNCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=CC3=CC=CC=C3N=C2)N4CCCNCC4

InChI

InChI=1S/C23H26ClN3O/c1-2-28-22-9-8-19(24)15-20(22)23(27-12-5-10-25-11-13-27)18-14-17-6-3-4-7-21(17)26-16-18/h3-4,6-9,14-16,23,25H,2,5,10-13H2,1H3