3-(3-methoxy-4-propan-2-yloxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: 3-(3-methoxy-4-propan-2-yloxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one Openeye Name: 3-(4-isopropoxy-3-methoxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one CAS Name: 3-(3-methoxy-4-propan-2-yloxyphenyl)-1-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-(3-methoxy-4-propan-2-yloxyphenyl)-1-piperazin-4-ium-1-ylpropan-1-one Traditional Name: 3-(4-isopropoxy-3-methoxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one Formula: C17H27N2O3+ MolecularWeight: 307.40788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)CCC(=O)N2CC[NH2+]CC2)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)CCC(=O)N2CC[NH2+]CC2)OC

InChI

InChI=1S/C17H26N2O3/c1-13(2)22-15-6-4-14(12-16(15)21-3)5-7-17(20)19-10-8-18-9-11-19/h4,6,12-13,18H,5,7-11H2,1-3H3/p+1