2-[7,10-bis(chloranyl)-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indol-6-yl]-N-(3-tert-butylphenyl)ethanamide

Systemtic Name: 2-[7,10-bis(chloranyl)-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indol-6-yl]-N-(3-tert-butylphenyl)ethanamide Openeye Name: N-(3-tert-butylphenyl)-2-(7,10-dichloro-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indol-6-yl)acetamide CAS Name: N-(3-tert-butylphenyl)-2-(7,10-dichloro-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indol-6-yl)acetamide IUPAC Name: N-(3-tert-butylphenyl)-2-(7,10-dichloro-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indol-6-yl)acetamide Traditional Name: N-(3-tert-butylphenyl)-2-(7,10-dichloro-2,3,4,5-tetrahydro-1H-azepin[4,5-b]indol-6-yl)acetamide Formula: C24H27Cl2N3O MolecularWeight: 444.39668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C1)NC(=O)CN2C3=C(CCNCC3)C4=C(C=CC(=C42)Cl)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C1)NC(=O)CN2C3=C(CCNCC3)C4=C(C=CC(=C42)Cl)Cl

InChI

InChI=1S/C24H27Cl2N3O/c1-24(2,3)15-5-4-6-16(13-15)28-21(30)14-29-20-10-12-27-11-9-17(20)22-18(25)7-8-19(26)23(22)29/h4-8,13,27H,9-12,14H2,1-3H3,(H,28,30)