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

Systemtic Name: 3-[1,4-diazepan-1-yl-(3-ethoxyphenyl)methyl]quinoline Openeye Name: 3-[1,4-diazepan-1-yl-(3-ethoxyphenyl)methyl]quinoline CAS Name: 3-[1,4-diazepan-1-yl-(3-ethoxyphenyl)methyl]quinoline IUPAC Name: 3-[1,4-diazepan-1-yl-(3-ethoxyphenyl)methyl]quinoline Traditional Name: 3-[1,4-diazepan-1-yl(m-phenetyl)methyl]quinoline Formula: C23H27N3O MolecularWeight: 361.47998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O/c1-2-27-21-9-5-8-19(16-21)23(26-13-6-11-24-12-14-26)20-15-18-7-3-4-10-22(18)25-17-20/h3-5,7-10,15-17,23-24H,2,6,11-14H2,1H3