2-[(4-chloranyl-3-methyl-phenoxy)methyl]-4-(4-chloranyl-3-methyl-phenyl)-3H-1,5-benzodiazepine

Systemtic Name: 2-[(4-chloranyl-3-methyl-phenoxy)methyl]-4-(4-chloranyl-3-methyl-phenyl)-3H-1,5-benzodiazepine Openeye Name: 2-[(4-chloro-3-methyl-phenoxy)methyl]-4-(4-chloro-3-methyl-phenyl)-3H-1,5-benzodiazepine CAS Name: 2-[(4-chloro-3-methylphenoxy)methyl]-4-(4-chloro-3-methylphenyl)-3H-1,5-benzodiazepine IUPAC Name: 2-[(4-chloro-3-methylphenoxy)methyl]-4-(4-chloro-3-methylphenyl)-3H-1,5-benzodiazepine Traditional Name: 2-[(4-chloro-3-methyl-phenoxy)methyl]-4-(4-chloro-3-methyl-phenyl)-3H-1,5-benzodiazepine Formula: C24H20Cl2N2O MolecularWeight: 423.3344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3N=C(C2)COC4=CC(=C(C=C4)Cl)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NC3=CC=CC=C3N=C(C2)COC4=CC(=C(C=C4)Cl)C)Cl

InChI

InChI=1S/C24H20Cl2N2O/c1-15-11-17(7-9-20(15)25)24-13-18(27-22-5-3-4-6-23(22)28-24)14-29-19-8-10-21(26)16(2)12-19/h3-12H,13-14H2,1-2H3