N-(3,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide Openeye Name: N-(3,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide CAS Name: N-(3,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: N-(3,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propanamide Traditional Name: N-(3,5-dimethoxyphenyl)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propionamide Formula: C17H29N3O4+2 MolecularWeight: 339.42986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CC[NH+]2CC[NH+](CC2)CCO)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CC[NH+]2CC[NH+](CC2)CCO)OC

InChI

InChI=1S/C17H27N3O4/c1-23-15-11-14(12-16(13-15)24-2)18-17(22)3-4-19-5-7-20(8-6-19)9-10-21/h11-13,21H,3-10H2,1-2H3,(H,18,22)/p+2