hydrogen sulfate; 1,3,4-trimethyl-7,8-dihydroquinazolin-1-ium-2-one

Systemtic Name: hydrogen sulfate; 1,3,4-trimethyl-7,8-dihydroquinazolin-1-ium-2-one Openeye Name: hydrogen sulfate; 1,3,4-trimethyl-7,8-dihydroquinazolin-1-ium-2-one CAS Name: hydrogen sulfate; 1,3,4-trimethyl-7,8-dihydroquinazolin-1-ium-2-one IUPAC Name: hydrogen sulfate; 1,3,4-trimethyl-7,8-dihydroquinazolin-1-ium-2-one Traditional Name: 1,3,4-trimethyl-7,8-dihydroquinazolin-1-ium-2-one bisulfate Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CCCC2=[N+](C(=O)N1C)C.OS(=O)(=O)[O-]

Isomeric SMILES

CC1=C2C=CCCC2=[N+](C(=O)N1C)C.OS(=O)(=O)[O-]

InChI

InChI=1S/C11H15N2O.H2O4S/c1-8-9-6-4-5-7-10(9)13(3)11(14)12(8)2;1-5(2,3)4/h4,6H,5,7H2,1-3H3;(H2,1,2,3,4)/q+1;/p-1