2-chloranyl-1-methyl-3-oxidanyl-4-prop-2-enyl-xanthen-9-one

Systemtic Name: 2-chloranyl-1-methyl-3-oxidanyl-4-prop-2-enyl-xanthen-9-one Openeye Name: 4-allyl-2-chloro-3-hydroxy-1-methyl-xanthen-9-one CAS Name: 2-chloro-3-hydroxy-1-methyl-4-prop-2-enyl-9-xanthenone IUPAC Name: 2-chloro-3-hydroxy-1-methyl-4-prop-2-enylxanthen-9-one Traditional Name: 4-allyl-2-chloro-3-hydroxy-1-methyl-xanthone Formula: C17H13ClO3 MolecularWeight: 300.73632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1Cl)O)CC=C)OC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=C2C(=C(C(=C1Cl)O)CC=C)OC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H13ClO3/c1-3-6-11-16(20)14(18)9(2)13-15(19)10-7-4-5-8-12(10)21-17(11)13/h3-5,7-8,20H,1,6H2,2H3