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

Systemtic Name: 3-(3-ethoxy-4-methoxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one Openeye Name: 3-(3-ethoxy-4-methoxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one CAS Name: 3-(3-ethoxy-4-methoxyphenyl)-1-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-(3-ethoxy-4-methoxyphenyl)-1-piperazin-4-ium-1-ylpropan-1-one Traditional Name: 3-(3-ethoxy-4-methoxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one Formula: C16H25N2O3+ MolecularWeight: 293.3813

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CCC(=O)N2CC[NH2+]CC2)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CCC(=O)N2CC[NH2+]CC2)OC

InChI

InChI=1S/C16H24N2O3/c1-3-21-15-12-13(4-6-14(15)20-2)5-7-16(19)18-10-8-17-9-11-18/h4,6,12,17H,3,5,7-11H2,1-2H3/p+1