3-bromanyl-7-methyl-phenanthrene-9-carboxylic acid

Systemtic Name: 3-bromanyl-7-methyl-phenanthrene-9-carboxylic acid Openeye Name: 3-bromo-7-methyl-phenanthrene-9-carboxylic acid CAS Name: 3-bromo-7-methyl-9-phenanthrenecarboxylic acid IUPAC Name: 3-bromo-7-methylphenanthrene-9-carboxylic acid Traditional Name: 3-bromo-7-methyl-phenanthrene-9-carboxylic acid Formula: C16H11BrO2 MolecularWeight: 315.16134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C3C=CC(=CC3=C2C=C1)Br)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C3C=CC(=CC3=C2C=C1)Br)C(=O)O

InChI

InChI=1S/C16H11BrO2/c1-9-2-5-12-13-8-11(17)4-3-10(13)7-15(16(18)19)14(12)6-9/h2-8H,1H3,(H,18,19)