sodium 10-(3-chloranyl-2-oxidanyl-propyl)-4-oxidanylidene-6,7,8,9-tetrahydrobenzo[g]chromene-2-carboxylate

Systemtic Name: sodium 10-(3-chloranyl-2-oxidanyl-propyl)-4-oxidanylidene-6,7,8,9-tetrahydrobenzo[g]chromene-2-carboxylate Openeye Name: sodium 10-(3-chloro-2-hydroxy-propyl)-4-oxo-6,7,8,9-tetrahydrobenzo[g]chromene-2-carboxylate CAS Name: sodium 10-(3-chloro-2-hydroxypropyl)-4-oxo-6,7,8,9-tetrahydrobenzo[g][1]benzopyran-2-carboxylate IUPAC Name: sodium 10-(3-chloro-2-hydroxypropyl)-4-oxo-6,7,8,9-tetrahydrobenzo[g]chromene-2-carboxylate Traditional Name: sodium 10-(3-chloro-2-hydroxy-propyl)-4-keto-6,7,8,9-tetrahydrobenzo[g]chromene-2-carboxylate Formula: C17H16ClNaO5 MolecularWeight: 358.74871

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C3C(=O)C=C(OC3=C2CC(CCl)O)C(=O)[O-].[Na+]

Isomeric SMILES

C1CCC2=C(C1)C=C3C(=O)C=C(OC3=C2CC(CCl)O)C(=O)[O-].[Na+]

InChI

InChI=1S/C17H17ClO5.Na/c18-8-10(19)6-12-11-4-2-1-3-9(11)5-13-14(20)7-15(17(21)22)23-16(12)13;/h5,7,10,19H,1-4,6,8H2,(H,21,22);/q;+1/p-1