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

Systemtic Name: 3-(4-methoxy-3-propoxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one Openeye Name: 3-(4-methoxy-3-propoxy-phenyl)-1-piperazin-4-ium-1-yl-propan-1-one CAS Name: 3-(4-methoxy-3-propoxyphenyl)-1-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-(4-methoxy-3-propoxyphenyl)-1-piperazin-4-ium-1-ylpropan-1-one Traditional Name: 3-(4-methoxy-3-propoxy-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:

CCCOC1=C(C=CC(=C1)CCC(=O)N2CC[NH2+]CC2)OC

Isomeric SMILES

CCCOC1=C(C=CC(=C1)CCC(=O)N2CC[NH2+]CC2)OC

InChI

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