1-[(5-chloranyl-2-ethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-chloranyl-2-ethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-chloro-2-ethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-chloro-2-ethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-chloro-2-ethoxyphenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-chloro-2-ethoxy-phenyl)-(4-phenylphenyl)methyl]-1,4-diazepane Formula: C26H29ClN2O MolecularWeight: 420.97426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCCNCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C(C2=CC=C(C=C2)C3=CC=CC=C3)N4CCCNCC4

InChI

InChI=1S/C26H29ClN2O/c1-2-30-25-14-13-23(27)19-24(25)26(29-17-6-15-28-16-18-29)22-11-9-21(10-12-22)20-7-4-3-5-8-20/h3-5,7-14,19,26,28H,2,6,15-18H2,1H3