1-[(5-chloranyl-2-methoxy-phenyl)-(4-ethylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-methoxy-phenyl)-(4-ethylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-methoxy-phenyl)-(4-ethylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-methoxyphenyl)-(4-ethylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-methoxyphenyl)-(4-ethylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-methoxy-phenyl)-(4-ethylphenyl)methyl]-1,4-diazepane Formula: C21H27ClN2O MolecularWeight: 358.90488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O/c1-3-16-5-7-17(8-6-16)21(24-13-4-11-23-12-14-24)19-15-18(22)9-10-20(19)25-2/h5-10,15,21,23H,3-4,11-14H2,1-2H3