(3R)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: (3R)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: (3R)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]chromane-3-carboxamide CAS Name: (3R)-N-[(2R)-3-ethyl-2-(4-morpholin-4-iumyl)pentyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: (3R)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-ylpentyl]-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: (3R)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]chroman-3-carboxamide Formula: C21H33N2O3+ MolecularWeight: 361.49832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1CC2=CC=CC=C2OC1)[NH+]3CCOCC3

Isomeric SMILES

CCC(CC)[C@H](CNC(=O)[C@@H]1CC2=CC=CC=C2OC1)[NH+]3CCOCC3

InChI

InChI=1S/C21H32N2O3/c1-3-16(4-2)19(23-9-11-25-12-10-23)14-22-21(24)18-13-17-7-5-6-8-20(17)26-15-18/h5-8,16,18-19H,3-4,9-15H2,1-2H3,(H,22,24)/p+1/t18-,19+/m1/s1