(3Z)-7-bromanyl-1-methyl-3-[3-(2-piperazin-1-ylethoxyamino)indol-2-ylidene]indol-2-one dihydrochloride

Systemtic Name: (3Z)-7-bromanyl-1-methyl-3-[3-(2-piperazin-1-ylethoxyamino)indol-2-ylidene]indol-2-one dihydrochloride Openeye Name: (3Z)-7-bromo-1-methyl-3-[3-(2-piperazin-1-ylethoxyamino)indol-2-ylidene]indolin-2-one dihydrochloride CAS Name: (3Z)-7-bromo-1-methyl-3-[3-[2-(1-piperazinyl)ethoxyamino]-2-indolylidene]-2-indolone dihydrochloride IUPAC Name: (3Z)-7-bromo-1-methyl-3-[3-(2-piperazin-1-ylethoxyamino)indol-2-ylidene]indol-2-one dihydrochloride Traditional Name: (3Z)-7-bromo-1-methyl-3-[3-(2-piperazinoethoxyamino)indol-2-ylidene]oxindole dihydrochloride Formula: C23H26BrCl2N5O2 MolecularWeight: 555.29484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC=C2Br)C(=C3C(=C4C=CC=CC4=N3)NOCCN5CCNCC5)C1=O.Cl.Cl

Isomeric SMILES

CN1C2=C(C=CC=C2Br)/C(=C/3\C(=C4C=CC=CC4=N3)NOCCN5CCNCC5)/C1=O.Cl.Cl

InChI

InChI=1S/C23H24BrN5O2.2ClH/c1-28-22-16(6-4-7-17(22)24)19(23(28)30)21-20(15-5-2-3-8-18(15)26-21)27-31-14-13-29-11-9-25-10-12-29;;/h2-8,25,27H,9-14H2,1H3;2*1H/b21-19-;;