[(2R)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-(3-methoxyphenyl)ethyl]azanium

Systemtic Name: [(2R)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-(3-methoxyphenyl)ethyl]azanium Openeye Name: [(2R)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-(3-methoxyphenyl)ethyl]ammonium CAS Name: [(2R)-2-[4-(cyclopropylmethyl)-1-piperazin-4-iumyl]-2-(3-methoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-(3-methoxyphenyl)ethyl]azanium Traditional Name: [(2R)-2-[4-(cyclopropylmethyl)piperazin-4-ium-1-yl]-2-(3-methoxyphenyl)ethyl]ammonium Formula: C17H29N3O+2 MolecularWeight: 291.43166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C[NH3+])N2CC[NH+](CC2)CC3CC3

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](C[NH3+])N2CC[NH+](CC2)CC3CC3

InChI

InChI=1S/C17H27N3O/c1-21-16-4-2-3-15(11-16)17(12-18)20-9-7-19(8-10-20)13-14-5-6-14/h2-4,11,14,17H,5-10,12-13,18H2,1H3/p+2/t17-/m0/s1