N-[[(3R)-1-cyclopropylpyrrolidin-1-ium-3-yl]methyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[[(3R)-1-cyclopropylpyrrolidin-1-ium-3-yl]methyl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[[(3R)-1-cyclopropylpyrrolidin-1-ium-3-yl]methyl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[[(3R)-1-cyclopropyl-3-pyrrolidin-1-iumyl]methyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[[(3R)-1-cyclopropylpyrrolidin-1-ium-3-yl]methyl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[[(3R)-1-cyclopropylpyrrolidin-1-ium-3-yl]methyl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+]2CCC(C2)CNC(=O)CCCN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1C[NH+](C[C@H]1CNC(=O)CCCN2C=NC3=CC=CC=C3C2=O)C4CC4

InChI

InChI=1S/C20H26N4O2/c25-19(21-12-15-9-11-23(13-15)16-7-8-16)6-3-10-24-14-22-18-5-2-1-4-17(18)20(24)26/h1-2,4-5,14-16H,3,6-13H2,(H,21,25)/p+1/t15-/m1/s1