2-phenyl-4-pyrrolidin-1-ium-1-yl-quinazoline

Systemtic Name: 2-phenyl-4-pyrrolidin-1-ium-1-yl-quinazoline Openeye Name: 2-phenyl-4-pyrrolidin-1-ium-1-yl-quinazoline CAS Name: 2-phenyl-4-(1-pyrrolidin-1-iumyl)quinazoline IUPAC Name: 2-phenyl-4-pyrrolidin-1-ium-1-ylquinazoline Traditional Name: 2-phenyl-4-pyrrolidin-1-ium-1-yl-quinazoline Formula: C18H18N3+ MolecularWeight: 276.35562

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)C2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C18H17N3/c1-2-8-14(9-3-1)17-19-16-11-5-4-10-15(16)18(20-17)21-12-6-7-13-21/h1-5,8-11H,6-7,12-13H2/p+1