methyl (Z)-2-(6'-ethyl-2-oxidanylidene-spiro[1H-indole-3,1'-2,3,4,5,6,7,8,8a-octahydroindolizin-4-ium]-7'-yl)-3-methoxy-prop-2-enoate chloride

Systemtic Name: methyl (Z)-2-(6'-ethyl-2-oxidanylidene-spiro[1H-indole-3,1'-2,3,4,5,6,7,8,8a-octahydroindolizin-4-ium]-7'-yl)-3-methoxy-prop-2-enoate chloride Openeye Name: methyl (Z)-2-(6-ethyl-2'-oxo-spiro[2,3,4,5,6,7,8,8a-octahydroindolizin-4-ium-1,3'-indoline]-7-yl)-3-methoxy-prop-2-enoate chloride CAS Name: (Z)-2-(6'-ethyl-2-oxo-7'-spiro[1H-indole-3,1'-2,3,4,5,6,7,8,8a-octahydroindolizin-4-ium]yl)-3-methoxy-2-propenoic acid methyl ester chloride IUPAC Name: methyl (Z)-2-(6'-ethyl-2-oxospiro[1H-indole-3,1'-2,3,4,5,6,7,8,8a-octahydroindolizin-4-ium]-7'-yl)-3-methoxyprop-2-enoate chloride Traditional Name: (Z)-2-(6'-ethyl-2-keto-spiro[indoline-3,1'-indolizidin-4-ium]-7'-yl)-3-methoxy-acrylic acid methyl ester chloride Formula: C22H29ClN2O4 MolecularWeight: 420.92966

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C[NH+]2CCC3(C2CC1C(=COC)C(=O)OC)C4=CC=CC=C4NC3=O.[Cl-]

Isomeric SMILES

CCC1C[NH+]2CCC3(C2CC1/C(=C/OC)/C(=O)OC)C4=CC=CC=C4NC3=O.[Cl-]

InChI

InChI=1S/C22H28N2O4.ClH/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3;/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26);1H/b16-13-;