6-[cyclopentylcarbonyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]amino]hexylazanium

Systemtic Name: 6-[cyclopentylcarbonyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]amino]hexylazanium Openeye Name: 6-[cyclopentanecarbonyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylammonium CAS Name: 6-[[cyclopentyl(oxo)methyl]-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylammonium IUPAC Name: 6-[cyclopentanecarbonyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylazanium Traditional Name: 6-[cyclopentanecarbonyl-[(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]amino]hexylammonium Formula: C22H33N4O2+ MolecularWeight: 385.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)N(CCCCCC[NH3+])C(=O)C3CCCC3

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)N(CCCCCC[NH3+])C(=O)C3CCCC3

InChI

InChI=1S/C22H32N4O2/c1-16(20-24-19-13-7-6-12-18(19)21(27)25-20)26(15-9-3-2-8-14-23)22(28)17-10-4-5-11-17/h6-7,12-13,16-17H,2-5,8-11,14-15,23H2,1H3,(H,24,25,27)/p+1/t16-/m1/s1