2-[(4S)-2-azanyl-3-ethoxycarbonyl-7-methyl-5-oxidanylidene-4-phenyl-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4S)-2-azanyl-3-ethoxycarbonyl-7-methyl-5-oxidanylidene-4-phenyl-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(4S)-2-amino-3-ethoxycarbonyl-7-methyl-5-oxo-4-phenyl-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(4S)-2-amino-3-ethoxycarbonyl-7-methyl-5-oxo-4-phenyl-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethylammonium IUPAC Name: 2-[(4S)-2-amino-3-ethoxycarbonyl-7-methyl-5-oxo-4-phenyl-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethylazanium Traditional Name: 2-[(4S)-2-amino-3-carbethoxy-5-keto-7-methyl-4-phenyl-4H-pyrano[3,2-c]pyridin-6-yl]ethyl-dimethyl-ammonium Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C(C1C3=CC=CC=C3)C(=O)N(C(=C2)C)CC[NH+](C)C)N

Isomeric SMILES

CCOC(=O)C1=C(OC2=C([C@@H]1C3=CC=CC=C3)C(=O)N(C(=C2)C)CC[NH+](C)C)N

InChI

InChI=1S/C22H27N3O4/c1-5-28-22(27)19-17(15-9-7-6-8-10-15)18-16(29-20(19)23)13-14(2)25(21(18)26)12-11-24(3)4/h6-10,13,17H,5,11-12,23H2,1-4H3/p+1/t17-/m0/s1