N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-3-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-3-phthalimido-propionamide Formula: C18H23N4O4+ MolecularWeight: 359.39962

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O)CC(=O)N

InChI

InChI=1S/C18H22N4O4/c19-15(23)11-21-8-5-12(6-9-21)20-16(24)7-10-22-17(25)13-3-1-2-4-14(13)18(22)26/h1-4,12H,5-11H2,(H2,19,23)(H,20,24)/p+1