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

Systemtic Name: 3-[(4S)-2-azanyl-3-cyano-7-methyl-5-oxidanylidene-4-pyridin-4-yl-4H-pyrano[3,2-c]pyridin-6-yl]propyl-dimethyl-azanium Openeye Name: 3-[(4S)-2-amino-3-cyano-7-methyl-5-oxo-4-(4-pyridyl)-4H-pyrano[3,2-c]pyridin-6-yl]propyl-dimethyl-ammonium CAS Name: 3-[(4S)-2-amino-3-cyano-7-methyl-5-oxo-4-pyridin-4-yl-4H-pyrano[3,2-c]pyridin-6-yl]propyl-dimethylammonium IUPAC Name: 3-[(4S)-2-amino-3-cyano-7-methyl-5-oxo-4-pyridin-4-yl-4H-pyrano[3,2-c]pyridin-6-yl]propyl-dimethylazanium Traditional Name: 3-[(4S)-2-amino-3-cyano-5-keto-7-methyl-4-(4-pyridyl)-4H-pyrano[3,2-c]pyridin-6-yl]propyl-dimethyl-ammonium Formula: C20H24N5O2+ MolecularWeight: 366.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=NC=C3)C(=O)N1CCC[NH+](C)C

Isomeric SMILES

CC1=CC2=C([C@H](C(=C(O2)N)C#N)C3=CC=NC=C3)C(=O)N1CCC[NH+](C)C

InChI

InChI=1S/C20H23N5O2/c1-13-11-16-18(20(26)25(13)10-4-9-24(2)3)17(14-5-7-23-8-6-14)15(12-21)19(22)27-16/h5-8,11,17H,4,9-10,22H2,1-3H3/p+1/t17-/m0/s1