2-(morpholin-4-ylmethyl)-N-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-amine

Systemtic Name: 2-(morpholin-4-ylmethyl)-N-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-amine Openeye Name: 2-(morpholinomethyl)-N-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-amine CAS Name: 2-(4-morpholinylmethyl)-N-[4-(1-pyrrolidin-1-iumyl)butyl]-4-quinazolinamine IUPAC Name: 2-(morpholin-4-ylmethyl)-N-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-amine Traditional Name: [2-(morpholinomethyl)quinazolin-4-yl]-(4-pyrrolidin-1-ium-1-ylbutyl)amine Formula: C21H32N5O+ MolecularWeight: 370.51168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCCNC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

Isomeric SMILES

C1CC[NH+](C1)CCCCNC2=NC(=NC3=CC=CC=C32)CN4CCOCC4

InChI

InChI=1S/C21H31N5O/c1-2-8-19-18(7-1)21(22-9-3-4-10-25-11-5-6-12-25)24-20(23-19)17-26-13-15-27-16-14-26/h1-2,7-8H,3-6,9-17H2,(H,22,23,24)/p+1