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

Systemtic Name: 5-[4-(4-methoxyphenoxy)butyl]-3-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 5-[4-(4-methoxyphenoxy)butyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 5-[4-(4-methoxyphenoxy)butyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 5-[4-(4-methoxyphenoxy)butyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 4-keto-5-[4-(4-methoxyphenoxy)butyl]-3-methyl-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O4/c1-17-15-23(16-25)20-7-3-4-8-21(20)24(22(17)26)13-5-6-14-28-19-11-9-18(27-2)10-12-19/h3-4,7-12,16-17H,5-6,13-15H2,1-2H3