6-chloranyl-4-cyclopropyl-3-methyl-4-[3-(1-oxidanidylpyridin-1-ium-2-yl)oxyprop-1-ynyl]-1H-quinazolin-2-one

Systemtic Name: 6-chloranyl-4-cyclopropyl-3-methyl-4-[3-(1-oxidanidylpyridin-1-ium-2-yl)oxyprop-1-ynyl]-1H-quinazolin-2-one Openeye Name: 6-chloro-4-cyclopropyl-3-methyl-4-[3-(1-oxidopyridin-1-ium-2-yl)oxyprop-1-ynyl]-1H-quinazolin-2-one CAS Name: 6-chloro-4-cyclopropyl-3-methyl-4-[3-[(1-oxido-2-pyridin-1-iumyl)oxy]prop-1-ynyl]-1H-quinazolin-2-one IUPAC Name: 6-chloro-4-cyclopropyl-3-methyl-4-[3-(1-oxidopyridin-1-ium-2-yl)oxyprop-1-ynyl]-1H-quinazolin-2-one Traditional Name: 6-chloro-4-cyclopropyl-3-methyl-4-[3-(1-oxidopyridin-1-ium-2-yl)oxyprop-1-ynyl]-1H-quinazolin-2-one Formula: C20H18ClN3O3 MolecularWeight: 383.82822

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)NC2=C(C1(C#CCOC3=CC=CC=[N+]3[O-])C4CC4)C=C(C=C2)Cl

Isomeric SMILES

CN1C(=O)NC2=C(C1(C#CCOC3=CC=CC=[N+]3[O-])C4CC4)C=C(C=C2)Cl

InChI

InChI=1S/C20H18ClN3O3/c1-23-19(25)22-17-9-8-15(21)13-16(17)20(23,14-6-7-14)10-4-12-27-18-5-2-3-11-24(18)26/h2-3,5,8-9,11,13-14H,6-7,12H2,1H3,(H,22,25)