2,3-dihydro-1H-inden-5-ol; 2-phenylpropanedioate

Systemtic Name: 2,3-dihydro-1H-inden-5-ol; 2-phenylpropanedioate Openeye Name: indan-5-ol; 2-phenylpropanedioate CAS Name: 2,3-dihydro-1H-inden-5-ol; 2-phenylpropanedioate IUPAC Name: 2,3-dihydro-1H-inden-5-ol; 2-phenylpropanedioate Traditional Name: indan-5-ol; 2-phenylmalonate Formula: C18H16O5-2 MolecularWeight: 312.31664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)O.C1=CC=C(C=C1)C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)O.C1=CC=C(C=C1)C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C9H8O4.C9H10O/c10-8(11)7(9(12)13)6-4-2-1-3-5-6;10-9-5-4-7-2-1-3-8(7)6-9/h1-5,7H,(H,10,11)(H,12,13);4-6,10H,1-3H2/p-2