(2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(2-methoxy-4-prop-2-enyl-phenoxy)propan-2-ol

Systemtic Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(2-methoxy-4-prop-2-enyl-phenoxy)propan-2-ol Openeye Name: (2S)-1-(4-allyl-2-methoxy-phenoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(4-ethyl-1-piperazin-4-iumyl)-3-(2-methoxy-4-prop-2-enylphenoxy)-2-propanol IUPAC Name: (2S)-1-(4-ethylpiperazin-4-ium-1-yl)-3-(2-methoxy-4-prop-2-enylphenoxy)propan-2-ol Traditional Name: (2S)-1-(4-allyl-2-methoxy-phenoxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C19H31N2O3+ MolecularWeight: 335.46104

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC2=C(C=C(C=C2)CC=C)OC)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](COC2=C(C=C(C=C2)CC=C)OC)O

InChI

InChI=1S/C19H30N2O3/c1-4-6-16-7-8-18(19(13-16)23-3)24-15-17(22)14-21-11-9-20(5-2)10-12-21/h4,7-8,13,17,22H,1,5-6,9-12,14-15H2,2-3H3/p+1/t17-/m0/s1