3-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-1H-quinazoline-2,4-dione Openeye Name: 3-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-1H-quinazoline-2,4-dione CAS Name: 3-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-1H-quinazoline-2,4-dione Traditional Name: 3-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]-1H-quinazoline-2,4-quinone Formula: C19H20N3O2+ MolecularWeight: 322.381

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C19H19N3O2/c23-18-16-5-1-2-6-17(16)20-19(24)22(18)15-9-7-14(8-10-15)13-21-11-3-4-12-21/h1-2,5-10H,3-4,11-13H2,(H,20,24)/p+1