(2S)-N-cyclopropyl-2-[4-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-cyclopropyl-2-[4-[(2S)-2-oxidanyl-3-(4-phenylphenoxy)propyl]piperazin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-cyclopropyl-2-[4-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]piperazin-1-ium-1-yl]propanamide CAS Name: (2S)-N-cyclopropyl-2-[4-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: (2S)-N-cyclopropyl-2-[4-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]piperazin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-cyclopropyl-2-[4-[(2S)-2-hydroxy-3-(4-phenylphenoxy)propyl]piperazin-1-ium-1-yl]propionamide Formula: C25H34N3O3+ MolecularWeight: 424.55576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)[NH+]2CCN(CC2)CC(COC3=CC=C(C=C3)C4=CC=CC=C4)O

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)[NH+]2CCN(CC2)C[C@@H](COC3=CC=C(C=C3)C4=CC=CC=C4)O

InChI

InChI=1S/C25H33N3O3/c1-19(25(30)26-22-9-10-22)28-15-13-27(14-16-28)17-23(29)18-31-24-11-7-21(8-12-24)20-5-3-2-4-6-20/h2-8,11-12,19,22-23,29H,9-10,13-18H2,1H3,(H,26,30)/p+1/t19-,23-/m0/s1