[2,5-bis(oxidanylidene)-1-propan-2-yl-pyrrolidin-3-yl]-(4-morpholin-4-ium-4-ylphenyl)azanium

Systemtic Name: [2,5-bis(oxidanylidene)-1-propan-2-yl-pyrrolidin-3-yl]-(4-morpholin-4-ium-4-ylphenyl)azanium Openeye Name: (1-isopropyl-2,5-dioxo-pyrrolidin-3-yl)-(4-morpholin-4-ium-4-ylphenyl)ammonium CAS Name: (2,5-dioxo-1-propan-2-yl-3-pyrrolidinyl)-[4-(4-morpholin-4-iumyl)phenyl]ammonium IUPAC Name: (2,5-dioxo-1-propan-2-ylpyrrolidin-3-yl)-(4-morpholin-4-ium-4-ylphenyl)azanium Traditional Name: (1-isopropyl-2,5-diketo-pyrrolidin-3-yl)-(4-morpholin-4-ium-4-ylphenyl)ammonium Formula: C17H25N3O3+2 MolecularWeight: 319.3987

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)CC(C1=O)[NH2+]C2=CC=C(C=C2)[NH+]3CCOCC3

Isomeric SMILES

CC(C)N1C(=O)CC(C1=O)[NH2+]C2=CC=C(C=C2)[NH+]3CCOCC3

InChI

InChI=1S/C17H23N3O3/c1-12(2)20-16(21)11-15(17(20)22)18-13-3-5-14(6-4-13)19-7-9-23-10-8-19/h3-6,12,15,18H,7-11H2,1-2H3/p+2