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

Systemtic Name: cyclopropylmethyl-[(5R)-3-(4-methylpiperazin-4-ium-1-yl)carbonyl-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: cyclopropylmethyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: cyclopropylmethyl-[(5R)-3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: cyclopropylmethyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: cyclopropylmethyl-[(5R)-3-(4-methylpiperazin-4-ium-1-carbonyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C20H35N5O+2 MolecularWeight: 361.5248

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH2+]CC3CC3)C(=N1)C(=O)N4CC[NH+](CC4)C

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH2+]CC3CC3)C(=N1)C(=O)N4CC[NH+](CC4)C

InChI

InChI=1S/C20H33N5O/c1-3-8-25-18-7-6-16(21-14-15-4-5-15)13-17(18)19(22-25)20(26)24-11-9-23(2)10-12-24/h15-16,21H,3-14H2,1-2H3/p+2/t16-/m1/s1