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

Systemtic Name: 6-[2-methoxyethanoyl-[(1S)-1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]amino]hexylazanium Openeye Name: 6-[(2-methoxyacetyl)-[(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylammonium CAS Name: 6-[(2-methoxy-1-oxoethyl)-[(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylammonium IUPAC Name: 6-[(2-methoxyacetyl)-[(1S)-1-(4-oxo-1H-quinazolin-2-yl)ethyl]amino]hexylazanium Traditional Name: 6-[[(1S)-1-(4-keto-1H-quinazolin-2-yl)ethyl]-(2-methoxyacetyl)amino]hexylammonium Formula: C19H29N4O3+ MolecularWeight: 361.45856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N4O3/c1-14(18-21-16-10-6-5-9-15(16)19(25)22-18)23(17(24)13-26-2)12-8-4-3-7-11-20/h5-6,9-10,14H,3-4,7-8,11-13,20H2,1-2H3,(H,21,22,25)/p+1/t14-/m0/s1