1-[(3,4-diethoxyphenyl)-(3-fluorophenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(3,4-diethoxyphenyl)-(3-fluorophenyl)methyl]-1,4-diazepane Openeye Name: 1-[(3,4-diethoxyphenyl)-(3-fluorophenyl)methyl]-1,4-diazepane CAS Name: 1-[(3,4-diethoxyphenyl)-(3-fluorophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3,4-diethoxyphenyl)-(3-fluorophenyl)methyl]-1,4-diazepane Traditional Name: 1-[(3,4-diethoxyphenyl)-(3-fluorophenyl)methyl]-1,4-diazepane Formula: C22H29FN2O2 MolecularWeight: 372.476263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC(=CC=C2)F)N3CCCNCC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC(=CC=C2)F)N3CCCNCC3)OCC

InChI

InChI=1S/C22H29FN2O2/c1-3-26-20-10-9-18(16-21(20)27-4-2)22(17-7-5-8-19(23)15-17)25-13-6-11-24-12-14-25/h5,7-10,15-16,22,24H,3-4,6,11-14H2,1-2H3