N-[3-[(2R)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide

Systemtic Name: N-[3-[(2R)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanamide Openeye Name: N-[3-[(2R)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: N-[3-[(2R)-2-methyl-1-piperidin-1-iumyl]propyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide IUPAC Name: N-[3-[(2R)-2-methylpiperidin-1-ium-1-yl]propyl]-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: 3-(3-keto-1,4-benzoxazin-4-yl)-N-[3-[(2R)-2-methylpiperidin-1-ium-1-yl]propyl]propionamide Formula: C20H30N3O3+ MolecularWeight: 360.4705

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)CCN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

C[C@@H]1CCCC[NH+]1CCCNC(=O)CCN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C20H29N3O3/c1-16-7-4-5-12-22(16)13-6-11-21-19(24)10-14-23-17-8-2-3-9-18(17)26-15-20(23)25/h2-3,8-9,16H,4-7,10-15H2,1H3,(H,21,24)/p+1/t16-/m1/s1