1-[(4-ethylphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(4-ethylphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-ethylphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethylphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethylphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(4-ethylphenyl)-(4-methoxyphenyl)methyl]-1,4-diazepane Formula: C21H28N2O MolecularWeight: 324.45982

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=C(C=C2)OC)N3CCCNCC3

InChI

InChI=1S/C21H28N2O/c1-3-17-5-7-18(8-6-17)21(23-15-4-13-22-14-16-23)19-9-11-20(24-2)12-10-19/h5-12,21-22H,3-4,13-16H2,1-2H3