3-chloranyl-4-methoxy-5-(4-methylpentanoylamino)benzoate

Systemtic Name: 3-chloranyl-4-methoxy-5-(4-methylpentanoylamino)benzoate Openeye Name: 3-chloro-4-methoxy-5-(4-methylpentanoylamino)benzoate CAS Name: 3-chloro-4-methoxy-5-[(4-methyl-1-oxopentyl)amino]benzoate IUPAC Name: 3-chloro-4-methoxy-5-(4-methylpentanoylamino)benzoate Traditional Name: 3-chloro-4-methoxy-5-(4-methylpentanoylamino)benzoate Formula: C14H17ClNO4- MolecularWeight: 298.74208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=C(C(=CC(=C1)C(=O)[O-])Cl)OC

Isomeric SMILES

CC(C)CCC(=O)NC1=C(C(=CC(=C1)C(=O)[O-])Cl)OC

InChI

InChI=1S/C14H18ClNO4/c1-8(2)4-5-12(17)16-11-7-9(14(18)19)6-10(15)13(11)20-3/h6-8H,4-5H2,1-3H3,(H,16,17)(H,18,19)/p-1