3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide

Systemtic Name: 3-(4-oxidanylidene-1H-quinazolin-2-yl)-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]propanamide Openeye Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)-N-[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]propanamide IUPAC Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C22H25N4O2+ MolecularWeight: 377.4595

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C[C@@H]1NC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2/c27-21(11-10-20-24-19-9-5-4-8-18(19)22(28)25-20)23-17-12-13-26(15-17)14-16-6-2-1-3-7-16/h1-9,17H,10-15H2,(H,23,27)(H,24,25,28)/p+1/t17-/m1/s1