2,3-dihydro-1H-inden-2-yl-[(5R)-1-ethyl-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: 2,3-dihydro-1H-inden-2-yl-[(5R)-1-ethyl-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: [(5R)-1-ethyl-3-(4-methylpiperazin-4-ium-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-indan-2-yl-ammonium CAS Name: 2,3-dihydro-1H-inden-2-yl-[(5R)-1-ethyl-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: 2,3-dihydro-1H-inden-2-yl-[(5R)-1-ethyl-3-(4-methylpiperazin-4-ium-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: [(5R)-1-ethyl-3-(4-methylpiperazin-4-ium-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]-indan-2-yl-ammonium Formula: C24H35N5O+2 MolecularWeight: 409.5676

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)[NH2+]C3CC4=CC=CC=C4C3)C(=N1)C(=O)N5CC[NH+](CC5)C

Isomeric SMILES

CCN1C2=C(C[C@@H](CC2)[NH2+]C3CC4=CC=CC=C4C3)C(=N1)C(=O)N5CC[NH+](CC5)C

InChI

InChI=1S/C24H33N5O/c1-3-29-22-9-8-19(25-20-14-17-6-4-5-7-18(17)15-20)16-21(22)23(26-29)24(30)28-12-10-27(2)11-13-28/h4-7,19-20,25H,3,8-16H2,1-2H3/p+2/t19-/m1/s1