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

Systemtic Name: 6-[butanoyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]amino]hexylazanium Openeye Name: 6-[butanoyl-[(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]-(1-oxobutyl)amino]hexylammonium IUPAC Name: 6-[butanoyl-[(1R)-1-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]ethyl]amino]hexylazanium Traditional Name: 6-[butyryl-[(1R)-1-[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]ethyl]amino]hexylammonium Formula: C23H37N4O3+ MolecularWeight: 417.56488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H36N4O3/c1-4-11-21(28)26(15-10-6-5-9-14-24)18(2)22-25-20-13-8-7-12-19(20)23(29)27(22)16-17-30-3/h7-8,12-13,18H,4-6,9-11,14-17,24H2,1-3H3/p+1/t18-/m1/s1