6-butyl-4-methyl-3-oxidanidyl-2-propan-2-yl-quinazolin-3-ium

Systemtic Name: 6-butyl-4-methyl-3-oxidanidyl-2-propan-2-yl-quinazolin-3-ium Openeye Name: 6-butyl-2-isopropyl-4-methyl-3-oxido-quinazolin-3-ium CAS Name: 6-butyl-4-methyl-3-oxido-2-propan-2-ylquinazolin-3-ium IUPAC Name: 6-butyl-4-methyl-3-oxido-2-propan-2-ylquinazolin-3-ium Traditional Name: 6-butyl-2-isopropyl-4-methyl-3-oxido-quinazolin-3-ium Formula: C16H22N2O MolecularWeight: 258.35868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C([N+](=C2C)[O-])C(C)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C([N+](=C2C)[O-])C(C)C

InChI

InChI=1S/C16H22N2O/c1-5-6-7-13-8-9-15-14(10-13)12(4)18(19)16(17-15)11(2)3/h8-11H,5-7H2,1-4H3