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

Systemtic Name: 3-methyl-5-[2-(3-methylphenoxy)ethyl]-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 3-methyl-5-[2-(3-methylphenoxy)ethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 3-methyl-5-[2-(3-methylphenoxy)ethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 3-methyl-5-[2-(3-methylphenoxy)ethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 4-keto-3-methyl-5-[2-(3-methylphenoxy)ethyl]-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3/c1-15-6-5-7-17(12-15)25-11-10-22-19-9-4-3-8-18(19)21(14-23)13-16(2)20(22)24/h3-9,12,14,16H,10-11,13H2,1-2H3