3-(5-chloranyl-1-methyl-indol-3-yl)-4-[1-[3-(4-methylpiperazin-1-yl)propyl]indazol-3-yl]-1-oxidanidyl-pyrrol-1-ium-2-one

Systemtic Name: 3-(5-chloranyl-1-methyl-indol-3-yl)-4-[1-[3-(4-methylpiperazin-1-yl)propyl]indazol-3-yl]-1-oxidanidyl-pyrrol-1-ium-2-one Openeye Name: 3-(5-chloro-1-methyl-indol-3-yl)-4-[1-[3-(4-methylpiperazin-1-yl)propyl]indazol-3-yl]-1-oxido-pyrrol-1-ium-2-one CAS Name: 3-(5-chloro-1-methyl-3-indolyl)-4-[1-[3-(4-methyl-1-piperazinyl)propyl]-3-indazolyl]-1-oxido-2-pyrrol-1-iumone IUPAC Name: 3-(5-chloro-1-methylindol-3-yl)-4-[1-[3-(4-methylpiperazin-1-yl)propyl]indazol-3-yl]-1-oxidopyrrol-1-ium-2-one Traditional Name: 3-(5-chloro-1-methyl-indol-3-yl)-4-[1-[3-(4-methylpiperazino)propyl]indazol-3-yl]-1-oxido-pyrrol-1-ium-2-one Formula: C28H29ClN6O2 MolecularWeight: 517.02186

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCN2C3=CC=CC=C3C(=N2)C4=C(C(=O)[N+](=C4)[O-])C5=CN(C6=C5C=C(C=C6)Cl)C

Isomeric SMILES

CN1CCN(CC1)CCCN2C3=CC=CC=C3C(=N2)C4=C(C(=O)[N+](=C4)[O-])C5=CN(C6=C5C=C(C=C6)Cl)C

InChI

InChI=1S/C28H29ClN6O2/c1-31-12-14-33(15-13-31)10-5-11-34-25-7-4-3-6-20(25)27(30-34)23-18-35(37)28(36)26(23)22-17-32(2)24-9-8-19(29)16-21(22)24/h3-4,6-9,16-18H,5,10-15H2,1-2H3