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6-(azepan-1-ium-1-ylmethyl)-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate
6-(azepan-1-ium-1-ylmethyl)-4-oxidanylidene-2,3-dihydro-1H-cyclopenta[c]chromen-7-olate
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Descriptors Computed from Structure
Canonical SMILES:
C1CCC[NH+](CC1)CC2=C(C=CC3=C2OC(=O)C4=C3CCC4)[O-]
Isomeric SMILES
C1CCC[NH+](CC1)CC2=C(C=CC3=C2OC(=O)C4=C3CCC4)[O-]
InChI
InChI=1S/C19H23NO3/c21-17-9-8-14-13-6-5-7-15(13)19(22)23-18(14)16(17)12-20-10-3-1-2-4-11-20/h8-9,21H,1-7,10-12H2
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