4-tert-butyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine

Systemtic Name: 4-tert-butyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 4-tert-butyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 4-tert-butyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 4-tert-butyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 4-tert-butyl-4H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C16H18N2 MolecularWeight: 238.32752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1C2=CC=CN2C3=CC=CC=C3C=N1

Isomeric SMILES

CC(C)(C)C1C2=CC=CN2C3=CC=CC=C3C=N1

InChI

InChI=1S/C16H18N2/c1-16(2,3)15-14-9-6-10-18(14)13-8-5-4-7-12(13)11-17-15/h4-11,15H,1-3H3