4-chloranyl-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]phenol

Systemtic Name: 4-chloranyl-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]phenol Openeye Name: 4-chloro-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]phenol CAS Name: 4-chloro-2-[[2-(1-pyrrolidin-1-iumylmethyl)-4-quinazolinyl]amino]phenol IUPAC Name: 4-chloro-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]phenol Traditional Name: 4-chloro-2-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]phenol Formula: C19H20ClN4O+ MolecularWeight: 355.8413

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NC3=CC=CC=C3C(=N2)NC4=C(C=CC(=C4)Cl)O

Isomeric SMILES

C1CC[NH+](C1)CC2=NC3=CC=CC=C3C(=N2)NC4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C19H19ClN4O/c20-13-7-8-17(25)16(11-13)22-19-14-5-1-2-6-15(14)21-18(23-19)12-24-9-3-4-10-24/h1-2,5-8,11,25H,3-4,9-10,12H2,(H,21,22,23)/p+1