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

Systemtic Name: 6-[ethanoyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]amino]hexylazanium Openeye Name: 6-[acetyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]ethyl]amino]hexylammonium CAS Name: 6-[acetyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]ethyl]amino]hexylammonium IUPAC Name: 6-[acetyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]ethyl]amino]hexylazanium Traditional Name: 6-[acetyl-[(1R)-1-[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]ethyl]amino]hexylammonium Formula: C21H33N4O3+ MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N4O3/c1-16(24(17(2)26)13-9-5-4-8-12-22)20-23-19-11-7-6-10-18(19)21(27)25(20)14-15-28-3/h6-7,10-11,16H,4-5,8-9,12-15,22H2,1-3H3/p+1/t16-/m1/s1