dimethyl-[2-[[(1S)-1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)propyl]azaniumyl]ethyl]azanium

Systemtic Name: dimethyl-[2-[[(1S)-1-(4-oxidanylidene-3-propyl-quinazolin-2-yl)propyl]azaniumyl]ethyl]azanium Openeye Name: dimethyl-[2-[[(1S)-1-(4-oxo-3-propyl-quinazolin-2-yl)propyl]ammonio]ethyl]ammonium CAS Name: dimethyl-[2-[[(1S)-1-(4-oxo-3-propyl-2-quinazolinyl)propyl]ammonio]ethyl]ammonium IUPAC Name: dimethyl-[2-[[(1S)-1-(4-oxo-3-propylquinazolin-2-yl)propyl]azaniumyl]ethyl]azanium Traditional Name: 2-[[(1S)-1-(4-keto-3-propyl-quinazolin-2-yl)propyl]ammonio]ethyl-dimethyl-ammonium Formula: C18H30N4O+2 MolecularWeight: 318.457

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1C(CC)[NH2+]CC[NH+](C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1[C@H](CC)[NH2+]CC[NH+](C)C

InChI

InChI=1S/C18H28N4O/c1-5-12-22-17(15(6-2)19-11-13-21(3)4)20-16-10-8-7-9-14(16)18(22)23/h7-10,15,19H,5-6,11-13H2,1-4H3/p+2/t15-/m0/s1