4-(4-butylphenyl)-7-chloranyl-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine

Systemtic Name: 4-(4-butylphenyl)-7-chloranyl-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 4-(4-butylphenyl)-7-chloro-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 4-(4-butylphenyl)-7-chloro-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 4-(4-butylphenyl)-7-chloro-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 4-(4-butylphenyl)-7-chloro-5,6-dihydro-4H-pyrrolo[1,2-a][1,4]benzodiazepine Formula: C22H23ClN2 MolecularWeight: 350.88442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2C3=CC=CN3C4=C(CN2)C(=CC=C4)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2C3=CC=CN3C4=C(CN2)C(=CC=C4)Cl

InChI

InChI=1S/C22H23ClN2/c1-2-3-6-16-10-12-17(13-11-16)22-21-9-5-14-25(21)20-8-4-7-19(23)18(20)15-24-22/h4-5,7-14,22,24H,2-3,6,15H2,1H3