N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide Openeye Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide CAS Name: N-[(1-ethyl-2-pyrrolidin-1-iumyl)methyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide Traditional Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-6-methyl-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2CNC3=C(O2)C=CC(=C3)C

Isomeric SMILES

CC[NH+]1CCCC1CNC(=O)C2CNC3=C(O2)C=CC(=C3)C

InChI

InChI=1S/C17H25N3O2/c1-3-20-8-4-5-13(20)10-19-17(21)16-11-18-14-9-12(2)6-7-15(14)22-16/h6-7,9,13,16,18H,3-5,8,10-11H2,1-2H3,(H,19,21)/p+1