5-[2-(4-chloranyl-3-methyl-phenoxy)ethyl]-3-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde

Systemtic Name: 5-[2-(4-chloranyl-3-methyl-phenoxy)ethyl]-3-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 5-[2-(4-chloro-3-methyl-phenoxy)ethyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 5-[2-(4-chloro-3-methylphenoxy)ethyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 5-[2-(4-chloro-3-methylphenoxy)ethyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 5-[2-(4-chloro-3-methyl-phenoxy)ethyl]-4-keto-3-methyl-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C20H21ClN2O3 MolecularWeight: 372.84534

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCOC3=CC(=C(C=C3)Cl)C)C=O

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCOC3=CC(=C(C=C3)Cl)C)C=O

InChI

InChI=1S/C20H21ClN2O3/c1-14-11-16(7-8-17(14)21)26-10-9-23-19-6-4-3-5-18(19)22(13-24)12-15(2)20(23)25/h3-8,11,13,15H,9-10,12H2,1-2H3