2-[(9S)-2-methoxy-9H-xanthen-9-yl]propanedioate

Systemtic Name: 2-[(9S)-2-methoxy-9H-xanthen-9-yl]propanedioate Openeye Name: 2-[(9S)-2-methoxy-9H-xanthen-9-yl]propanedioate CAS Name: 2-[(9S)-2-methoxy-9H-xanthen-9-yl]propanedioate IUPAC Name: 2-[(9S)-2-methoxy-9H-xanthen-9-yl]propanedioate Traditional Name: 2-[(9S)-2-methoxy-9H-xanthen-9-yl]malonate Formula: C17H12O6-2 MolecularWeight: 312.27358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC3=CC=CC=C3C2C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)OC3=CC=CC=C3[C@@H]2C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H14O6/c1-22-9-6-7-13-11(8-9)14(15(16(18)19)17(20)21)10-4-2-3-5-12(10)23-13/h2-8,14-15H,1H3,(H,18,19)(H,20,21)/p-2/t14-/m0/s1