3-azanyl-10-[(4-chlorophenyl)methyl]-1-oxidanylidene-2,5-dihydroazepino[3,4-b]indole-4-carbonitrile

Systemtic Name: 3-azanyl-10-[(4-chlorophenyl)methyl]-1-oxidanylidene-2,5-dihydroazepino[3,4-b]indole-4-carbonitrile Openeye Name: 3-amino-10-[(4-chlorophenyl)methyl]-1-oxo-2,5-dihydroazepino[3,4-b]indole-4-carbonitrile CAS Name: 3-amino-10-[(4-chlorophenyl)methyl]-1-oxo-2,5-dihydroazepino[3,4-b]indole-4-carbonitrile IUPAC Name: 3-amino-10-[(4-chlorophenyl)methyl]-1-oxo-2,5-dihydroazepino[3,4-b]indole-4-carbonitrile Traditional Name: 3-amino-10-(4-chlorobenzyl)-1-keto-2,5-dihydroazepin[3,4-b]indole-4-carbonitrile Formula: C20H15ClN4O MolecularWeight: 362.8123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(NC(=O)C2=C1C3=CC=CC=C3N2CC4=CC=C(C=C4)Cl)N)C#N

Isomeric SMILES

C1C(=C(NC(=O)C2=C1C3=CC=CC=C3N2CC4=CC=C(C=C4)Cl)N)C#N

InChI

InChI=1S/C20H15ClN4O/c21-14-7-5-12(6-8-14)11-25-17-4-2-1-3-15(17)16-9-13(10-22)19(23)24-20(26)18(16)25/h1-8H,9,11,23H2,(H,24,26)