6-[2-methoxyethanoyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]amino]hexylazanium

Systemtic Name: 6-[2-methoxyethanoyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]amino]hexylazanium Openeye Name: 6-[(2-methoxyacetyl)-[(1R)-1-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]ethyl]amino]hexylammonium CAS Name: 6-[[(1R)-1-[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]ethyl]-(2-methoxy-1-oxoethyl)amino]hexylammonium IUPAC Name: 6-[(2-methoxyacetyl)-[(1R)-1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]ethyl]amino]hexylazanium Traditional Name: 6-[[(1R)-1-[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]ethyl]-(2-methoxyacetyl)amino]hexylammonium Formula: C22H35N4O4+ MolecularWeight: 419.5377

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=O)N1CCOC)N(CCCCCC[NH3+])C(=O)COC

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2C(=O)N1CCOC)N(CCCCCC[NH3+])C(=O)COC

InChI

InChI=1S/C22H34N4O4/c1-17(25(20(27)16-30-3)13-9-5-4-8-12-23)21-24-19-11-7-6-10-18(19)22(28)26(21)14-15-29-2/h6-7,10-11,17H,4-5,8-9,12-16,23H2,1-3H3/p+1/t17-/m1/s1