(2R)-4-[2-(4-piperidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: (2R)-4-[2-(4-piperidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: (2R)-4-[2-[4-(piperidine-1-carbonyl)piperidin-1-ium-1-yl]acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: (2R)-4-[1-oxo-2-[4-[oxo(1-piperidinyl)methyl]-1-piperidin-1-iumyl]ethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: (2R)-4-[2-[4-(piperidine-1-carbonyl)piperidin-1-ium-1-yl]acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: (2R)-4-[2-[4-(piperidine-1-carbonyl)piperidin-1-ium-1-yl]acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C22H31N4O4+ MolecularWeight: 415.50594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)N3CC(OC4=CC=CC=C43)C(=O)N

Isomeric SMILES

C1CCN(CC1)C(=O)C2CC[NH+](CC2)CC(=O)N3C[C@@H](OC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C22H30N4O4/c23-21(28)19-14-26(17-6-2-3-7-18(17)30-19)20(27)15-24-12-8-16(9-13-24)22(29)25-10-4-1-5-11-25/h2-3,6-7,16,19H,1,4-5,8-15H2,(H2,23,28)/p+1/t19-/m1/s1