methyl 2-[4-chloranylbutyl(ethoxycarbonyl)amino]-6-methyl-benzoate

Systemtic Name: methyl 2-[4-chloranylbutyl(ethoxycarbonyl)amino]-6-methyl-benzoate Openeye Name: methyl 2-[4-chlorobutyl(ethoxycarbonyl)amino]-6-methyl-benzoate CAS Name: 2-[4-chlorobutyl(ethoxycarbonyl)amino]-6-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[4-chlorobutyl(ethoxycarbonyl)amino]-6-methylbenzoate Traditional Name: 2-[carbethoxy(4-chlorobutyl)amino]-6-methyl-benzoic acid methyl ester Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N(CCCCCl)C1=CC=CC(=C1C(=O)OC)C

Isomeric SMILES

CCOC(=O)N(CCCCCl)C1=CC=CC(=C1C(=O)OC)C

InChI

InChI=1S/C16H22ClNO4/c1-4-22-16(20)18(11-6-5-10-17)13-9-7-8-12(2)14(13)15(19)21-3/h7-9H,4-6,10-11H2,1-3H3