3-[ethyl(2-methylprop-2-enyl)carbamoyl]benzoic acid

Systemtic Name: 3-[ethyl(2-methylprop-2-enyl)carbamoyl]benzoic acid Openeye Name: 3-[ethyl(2-methylallyl)carbamoyl]benzoic acid CAS Name: 3-[[ethyl(2-methylprop-2-enyl)amino]-oxomethyl]benzoic acid IUPAC Name: 3-[ethyl(2-methylprop-2-enyl)carbamoyl]benzoic acid Traditional Name: 3-[ethyl(2-methylallyl)carbamoyl]benzoic acid Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=C)C)C(=O)C1=CC(=CC=C1)C(=O)O

Isomeric SMILES

CCN(CC(=C)C)C(=O)C1=CC(=CC=C1)C(=O)O

InChI

InChI=1S/C14H17NO3/c1-4-15(9-10(2)3)13(16)11-6-5-7-12(8-11)14(17)18/h5-8H,2,4,9H2,1,3H3,(H,17,18)