2-chloranyl-4-methoxy-benzoic acid; N-(2-diethylaminoethyl)methanamide

Systemtic Name: 2-chloranyl-4-methoxy-benzoic acid; N-(2-diethylaminoethyl)methanamide Openeye Name: 2-chloro-4-methoxy-benzoic acid; N-(2-diethylaminoethyl)formamide CAS Name: 2-chloro-4-methoxybenzoic acid; N-(2-diethylaminoethyl)formamide IUPAC Name: 2-chloro-4-methoxybenzoic acid; N-(2-diethylaminoethyl)formamide Traditional Name: 2-chloro-4-methoxy-benzoic acid; N-(2-diethylaminoethyl)formamide Formula: C15H23ClN2O4 MolecularWeight: 330.80712

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC=O.COC1=CC(=C(C=C1)C(=O)O)Cl

Isomeric SMILES

CCN(CC)CCNC=O.COC1=CC(=C(C=C1)C(=O)O)Cl

InChI

InChI=1S/C8H7ClO3.C7H16N2O/c1-12-5-2-3-6(8(10)11)7(9)4-5;1-3-9(4-2)6-5-8-7-10/h2-4H,1H3,(H,10,11);7H,3-6H2,1-2H3,(H,8,10)