2-(4-oxidanylidenequinazolin-3-yl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-(4-oxidanylidenequinazolin-3-yl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: 2-(4-oxo-3-quinazolinyl)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-(4-ketoquinazolin-3-yl)acetamide Formula: C21H23N4O2+ MolecularWeight: 363.43292

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC1NC(=O)CN2C=NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C[C@H]1NC(=O)CN2C=NC3=CC=CC=C3C2=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O2/c26-20(14-25-15-22-19-9-5-4-8-18(19)21(25)27)23-17-10-11-24(13-17)12-16-6-2-1-3-7-16/h1-9,15,17H,10-14H2,(H,23,26)/p+1/t17-/m0/s1