(2S)-N-ethyl-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide

Systemtic Name: (2S)-N-ethyl-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2S)-N-ethyl-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide CAS Name: (2S)-N-ethyl-2-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2S)-N-ethyl-2-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2S)-N-ethyl-2-(4-p-anisylpiperazine-1,4-diium-1-yl)propionamide Formula: C17H29N3O2+2 MolecularWeight: 307.43106

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCNC(=O)[C@H](C)[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H27N3O2/c1-4-18-17(21)14(2)20-11-9-19(10-12-20)13-15-5-7-16(22-3)8-6-15/h5-8,14H,4,9-13H2,1-3H3,(H,18,21)/p+2/t14-/m0/s1