3-[1,4-diazepan-1-yl-(3-ethoxy-4-phenylmethoxy-phenyl)methyl]quinoline

Systemtic Name: 3-[1,4-diazepan-1-yl-(3-ethoxy-4-phenylmethoxy-phenyl)methyl]quinoline Openeye Name: 3-[(4-benzyloxy-3-ethoxy-phenyl)-(1,4-diazepan-1-yl)methyl]quinoline CAS Name: 3-[1,4-diazepan-1-yl-(3-ethoxy-4-phenylmethoxyphenyl)methyl]quinoline IUPAC Name: 3-[1,4-diazepan-1-yl-(3-ethoxy-4-phenylmethoxyphenyl)methyl]quinoline Traditional Name: 3-[(4-benzoxy-3-ethoxy-phenyl)-(1,4-diazepan-1-yl)methyl]quinoline Formula: C30H33N3O2 MolecularWeight: 467.60192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCNCC4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(C2=CC3=CC=CC=C3N=C2)N4CCCNCC4)OCC5=CC=CC=C5

InChI

InChI=1S/C30H33N3O2/c1-2-34-29-20-25(13-14-28(29)35-22-23-9-4-3-5-10-23)30(33-17-8-15-31-16-18-33)26-19-24-11-6-7-12-27(24)32-21-26/h3-7,9-14,19-21,30-31H,2,8,15-18,22H2,1H3