ethyl 2-azanyl-3-cyano-7-ethyl-thiopyrano[3,2-a]indolizin-9-ium-10-carboxylate chloride

Systemtic Name: ethyl 2-azanyl-3-cyano-7-ethyl-thiopyrano[3,2-a]indolizin-9-ium-10-carboxylate chloride Openeye Name: ethyl 2-amino-3-cyano-7-ethyl-thiopyrano[3,2-a]indolizin-9-ium-10-carboxylate chloride CAS Name: 2-amino-3-cyano-7-ethyl-10-thiopyrano[3,2-a]indolizin-9-iumcarboxylic acid ethyl ester chloride IUPAC Name: ethyl 2-amino-3-cyano-7-ethylthiopyrano[3,2-a]indolizin-9-ium-10-carboxylate chloride Traditional Name: 2-amino-3-cyano-7-ethyl-thiopyran[3,2-a]indolizin-9-ium-10-carboxylic acid ethyl ester chloride Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+]2=C(C=C1)C3=CC(=C(SC3=C2C(=O)OCC)N)C#N.[Cl-]

Isomeric SMILES

CCC1=C[N+]2=C(C=C1)C3=CC(=C(SC3=C2C(=O)OCC)N)C#N.[Cl-]

InChI

InChI=1S/C17H15N3O2S.ClH/c1-3-10-5-6-13-12-7-11(8-18)16(19)23-15(12)14(20(13)9-10)17(21)22-4-2;/h5-7,9,19H,3-4H2,1-2H3;1H