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

Systemtic Name: 3-methyl-4-oxidanylidene-5-[4-(4-propan-2-ylphenoxy)butyl]-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 5-[4-(4-isopropylphenoxy)butyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 3-methyl-4-oxo-5-[4-(4-propan-2-ylphenoxy)butyl]-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 3-methyl-4-oxo-5-[4-(4-propan-2-ylphenoxy)butyl]-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 5-[4-(4-isopropylphenoxy)butyl]-4-keto-3-methyl-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C24H30N2O3 MolecularWeight: 394.5066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O3/c1-18(2)20-10-12-21(13-11-20)29-15-7-6-14-26-23-9-5-4-8-22(23)25(17-27)16-19(3)24(26)28/h4-5,8-13,17-19H,6-7,14-16H2,1-3H3