2-methoxyethyl-methyl-[(5R)-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: 2-methoxyethyl-methyl-[(5R)-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: 2-methoxyethyl-methyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: 2-methoxyethyl-methyl-[(5R)-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: 2-methoxyethyl-methyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: 2-methoxyethyl-methyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C20H37N5O2+2 MolecularWeight: 379.54008

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH+](C)CCOC)C(=N1)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH+](C)CCOC)C(=N1)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C20H35N5O2/c1-5-8-25-18-7-6-16(23(3)13-14-27-4)15-17(18)19(21-25)20(26)24-11-9-22(2)10-12-24/h16H,5-15H2,1-4H3/p+2/t16-/m1/s1