7-bromanyl-3-[3-(2-imidazol-1-ylethoxyamino)-1H-indol-2-yl]indol-2-one hydrochloride

Systemtic Name: 7-bromanyl-3-[3-(2-imidazol-1-ylethoxyamino)-1H-indol-2-yl]indol-2-one hydrochloride Openeye Name: 7-bromo-3-[3-(2-imidazol-1-ylethoxyamino)-1H-indol-2-yl]indol-2-one hydrochloride CAS Name: 7-bromo-3-[3-[2-(1-imidazolyl)ethoxyamino]-1H-indol-2-yl]-2-indolone hydrochloride IUPAC Name: 7-bromo-3-[3-(2-imidazol-1-ylethoxyamino)-1H-indol-2-yl]indol-2-one hydrochloride Traditional Name: 7-bromo-3-[3-(2-imidazol-1-ylethoxyamino)-1H-indol-2-yl]indol-2-one hydrochloride Formula: C21H17BrClN5O2 MolecularWeight: 486.74898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2)C3=C4C=CC=C(C4=NC3=O)Br)NOCCN5C=CN=C5.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2)C3=C4C=CC=C(C4=NC3=O)Br)NOCCN5C=CN=C5.Cl

InChI

InChI=1S/C21H16BrN5O2.ClH/c22-15-6-3-5-14-17(21(28)25-18(14)15)20-19(13-4-1-2-7-16(13)24-20)26-29-11-10-27-9-8-23-12-27;/h1-9,12,24,26H,10-11H2;1H