3-cyano-4-methyl-2-prop-2-enyl-naphthalene-1-carboxylic acid

Systemtic Name: 3-cyano-4-methyl-2-prop-2-enyl-naphthalene-1-carboxylic acid Openeye Name: 2-allyl-3-cyano-4-methyl-naphthalene-1-carboxylic acid CAS Name: 3-cyano-4-methyl-2-prop-2-enyl-1-naphthalenecarboxylic acid IUPAC Name: 3-cyano-4-methyl-2-prop-2-enylnaphthalene-1-carboxylic acid Traditional Name: 2-allyl-3-cyano-4-methyl-1-naphthoic acid Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=CC=CC=C12)C(=O)O)CC=C)C#N

Isomeric SMILES

CC1=C(C(=C(C2=CC=CC=C12)C(=O)O)CC=C)C#N

InChI

InChI=1S/C16H13NO2/c1-3-6-12-14(9-17)10(2)11-7-4-5-8-13(11)15(12)16(18)19/h3-5,7-8H,1,6H2,2H3,(H,18,19)