methyl 5-[[1-(3-chlorophenyl)ethylamino]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[1-(3-chlorophenyl)ethylamino]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[1-(3-chlorophenyl)ethylamino]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[1-(3-chlorophenyl)ethylamino]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[1-(3-chlorophenyl)ethylamino]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[1-(3-chlorophenyl)ethylamino]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C16H18ClNO3 MolecularWeight: 307.77202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CNC(C)C2=CC(=CC=C2)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CNC(C)C2=CC(=CC=C2)Cl)C(=O)OC

InChI

InChI=1S/C16H18ClNO3/c1-10(12-5-4-6-13(17)7-12)18-9-14-8-15(11(2)21-14)16(19)20-3/h4-8,10,18H,9H2,1-3H3