3-methyl-4-oxidanylidene-5-(4-phenoxybutyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde

Systemtic Name: 3-methyl-4-oxidanylidene-5-(4-phenoxybutyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 3-methyl-4-oxo-5-(4-phenoxybutyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 3-methyl-4-oxo-5-(4-phenoxybutyl)-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 3-methyl-4-oxo-5-(4-phenoxybutyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 4-keto-3-methyl-5-(4-phenoxybutyl)-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=CC=CC=C3)C=O

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=CC=CC=C3)C=O

InChI

InChI=1S/C21H24N2O3/c1-17-15-22(16-24)19-11-5-6-12-20(19)23(21(17)25)13-7-8-14-26-18-9-3-2-4-10-18/h2-6,9-12,16-17H,7-8,13-15H2,1H3