1-[(4-ethylphenyl)-(3-methoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(4-ethylphenyl)-(3-methoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(4-ethylphenyl)-(3-methoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethylphenyl)-(3-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethylphenyl)-(3-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(4-ethylphenyl)-(3-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(=CC=C2)OC)N3CCCNCC3

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O/c1-3-17-8-10-18(11-9-17)21(23-14-5-12-22-13-15-23)19-6-4-7-20(16-19)24-2/h4,6-11,16,21-22H,3,5,12-15H2,1-2H3