1-(2,2-dimethyl-3-oxidanyl-3,4-dihydropyrano[3,2-c]pyridin-4-yl)-1-ethanoyl-piperazin-1-ium-2-one

Systemtic Name: 1-(2,2-dimethyl-3-oxidanyl-3,4-dihydropyrano[3,2-c]pyridin-4-yl)-1-ethanoyl-piperazin-1-ium-2-one Openeye Name: 1-acetyl-1-(3-hydroxy-2,2-dimethyl-3,4-dihydropyrano[3,2-c]pyridin-4-yl)piperazin-1-ium-2-one CAS Name: 1-acetyl-1-(3-hydroxy-2,2-dimethyl-3,4-dihydropyrano[3,2-c]pyridin-4-yl)-2-piperazin-1-iumone IUPAC Name: 1-acetyl-1-(3-hydroxy-2,2-dimethyl-3,4-dihydropyrano[3,2-c]pyridin-4-yl)piperazin-1-ium-2-one Traditional Name: 1-acetyl-1-(3-hydroxy-2,2-dimethyl-3,4-dihydropyrano[3,2-c]pyridin-4-yl)piperazin-1-ium-2-one Formula: C16H22N3O4+ MolecularWeight: 320.36358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+]1(CCNCC1=O)C2C(C(OC3=C2C=NC=C3)(C)C)O

Isomeric SMILES

CC(=O)[N+]1(CCNCC1=O)C2C(C(OC3=C2C=NC=C3)(C)C)O

InChI

InChI=1S/C16H22N3O4/c1-10(20)19(7-6-18-9-13(19)21)14-11-8-17-5-4-12(11)23-16(2,3)15(14)22/h4-5,8,14-15,18,22H,6-7,9H2,1-3H3/q+1