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

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

Systemtic Name:3-[1,4-diazepan-1-yl-(3-phenylmethoxyphenyl)methyl]quinoline
Openeye Name:3-[(3-benzyloxyphenyl)-(1,4-diazepan-1-yl)methyl]quinoline
CAS Name:3-[1,4-diazepan-1-yl-(3-phenylmethoxyphenyl)methyl]quinoline
IUPAC Name:3-[1,4-diazepan-1-yl-(3-phenylmethoxyphenyl)methyl]quinoline
Traditional Name:3-[(3-benzoxyphenyl)-(1,4-diazepan-1-yl)methyl]quinoline
Formula: C28H29N3O
MolecularWeight: 423.54936
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4


Isomeric SMILES

C1CNCCN(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC5=CC=CC=C5N=C4


InChI

InChI=1S/C28H29N3O/c1-2-8-22(9-3-1)21-32-26-12-6-11-24(19-26)28(31-16-7-14-29-15-17-31)25-18-23-10-4-5-13-27(23)30-20-25/h1-6,8-13,18-20,28-29H,7,14-17,21H2


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