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

Systemtic Name: 5-[4-(2,3-dimethylphenoxy)butyl]-3-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 5-[4-(2,3-dimethylphenoxy)butyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 5-[4-(2,3-dimethylphenoxy)butyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 5-[4-(2,3-dimethylphenoxy)butyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 5-[4-(2,3-dimethylphenoxy)butyl]-4-keto-3-methyl-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=CC=CC(=C3C)C)C=O

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCCOC3=CC=CC(=C3C)C)C=O

InChI

InChI=1S/C23H28N2O3/c1-17-9-8-12-22(19(17)3)28-14-7-6-13-25-21-11-5-4-10-20(21)24(16-26)15-18(2)23(25)27/h4-5,8-12,16,18H,6-7,13-15H2,1-3H3