(2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-N-(3-piperidin-1-ium-1-ylpropyl)propanamide

Systemtic Name: (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Openeye Name: (2S)-2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-N-(3-piperidin-1-ium-1-ylpropyl)propanamide CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)-3-phenyl-N-[3-(1-piperidin-1-iumyl)propyl]propanamide IUPAC Name: (2S)-2-(1,3-dioxoisoindol-2-yl)-3-phenyl-N-(3-piperidin-1-ium-1-ylpropyl)propanamide Traditional Name: (2S)-3-phenyl-2-phthalimido-N-(3-piperidin-1-ium-1-ylpropyl)propionamide Formula: C25H30N3O3+ MolecularWeight: 420.524

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)C(CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)[C@H](CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H29N3O3/c29-23(26-14-9-17-27-15-7-2-8-16-27)22(18-19-10-3-1-4-11-19)28-24(30)20-12-5-6-13-21(20)25(28)31/h1,3-6,10-13,22H,2,7-9,14-18H2,(H,26,29)/p+1/t22-/m0/s1