N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide

Systemtic Name: N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide Openeye Name: N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: N-[(2R)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-2-(4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[(2R)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2-(4-ketoquinazolin-3-yl)acetamide Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)CN2C=NC3=CC=CC=C3C2=O)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](CC1)[C@H](CNC(=O)CN2C=NC3=CC=CC=C3C2=O)C4=CC=CO4

InChI

InChI=1S/C21H24N4O3/c26-20(14-25-15-23-17-8-3-2-7-16(17)21(25)27)22-13-18(19-9-6-12-28-19)24-10-4-1-5-11-24/h2-3,6-9,12,15,18H,1,4-5,10-11,13-14H2,(H,22,26)/p+1/t18-/m1/s1