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

Systemtic Name: 3-methyl-4-oxidanylidene-5-[3-(4-propan-2-ylphenoxy)propyl]-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 5-[3-(4-isopropylphenoxy)propyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 3-methyl-4-oxo-5-[3-(4-propan-2-ylphenoxy)propyl]-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 3-methyl-4-oxo-5-[3-(4-propan-2-ylphenoxy)propyl]-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 5-[3-(4-isopropylphenoxy)propyl]-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)CCCOC3=CC=C(C=C3)C(C)C)C=O

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CCCOC3=CC=C(C=C3)C(C)C)C=O

InChI

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