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

Systemtic Name: 5-[(4-tert-butylphenyl)methyl]-3-methyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Openeye Name: 5-[(4-tert-butylphenyl)methyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde CAS Name: 5-[(4-tert-butylphenyl)methyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carboxaldehyde IUPAC Name: 5-[(4-tert-butylphenyl)methyl]-3-methyl-4-oxo-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Traditional Name: 5-(4-tert-butylbenzyl)-4-keto-3-methyl-2,3-dihydro-1,5-benzodiazepine-1-carbaldehyde Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2N(C1=O)CC3=CC=C(C=C3)C(C)(C)C)C=O

Isomeric SMILES

CC1CN(C2=CC=CC=C2N(C1=O)CC3=CC=C(C=C3)C(C)(C)C)C=O

InChI

InChI=1S/C22H26N2O2/c1-16-13-23(15-25)19-7-5-6-8-20(19)24(21(16)26)14-17-9-11-18(12-10-17)22(2,3)4/h5-12,15-16H,13-14H2,1-4H3