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

Systemtic Name: 6-[cyclopropylcarbonyl-[(1R)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]amino]hexylazanium Openeye Name: 6-[cyclopropanecarbonyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylammonium CAS Name: 6-[[cyclopropyl(oxo)methyl]-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylammonium IUPAC Name: 6-[cyclopropanecarbonyl-[(1R)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylazanium Traditional Name: 6-[cyclopropanecarbonyl-[(1R)-1-(4-keto-1H-quinazolin-2-yl)ethyl]amino]hexylammonium Formula: C20H29N4O2+ MolecularWeight: 357.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)N(CCCCCC[NH3+])C(=O)C3CC3

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)N(CCCCCC[NH3+])C(=O)C3CC3

InChI

InChI=1S/C20H28N4O2/c1-14(18-22-17-9-5-4-8-16(17)19(25)23-18)24(20(26)15-10-11-15)13-7-3-2-6-12-21/h4-5,8-9,14-15H,2-3,6-7,10-13,21H2,1H3,(H,22,23,25)/p+1/t14-/m1/s1