methyl 3-[[[3-(2-chloranylethanoylamino)phenyl]amino]methyl]-5-methoxy-benzoate

Systemtic Name: methyl 3-[[[3-(2-chloranylethanoylamino)phenyl]amino]methyl]-5-methoxy-benzoate Openeye Name: methyl 3-[[3-[(2-chloroacetyl)amino]anilino]methyl]-5-methoxy-benzoate CAS Name: 3-[[3-[(2-chloro-1-oxoethyl)amino]anilino]methyl]-5-methoxybenzoic acid methyl ester IUPAC Name: methyl 3-[[3-[(2-chloroacetyl)amino]anilino]methyl]-5-methoxybenzoate Traditional Name: 3-[[3-[(2-chloroacetyl)amino]anilino]methyl]-5-methoxy-benzoic acid methyl ester Formula: C18H19ClN2O4 MolecularWeight: 362.80746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC2=CC=CC(=C2)NC(=O)CCl)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC2=CC=CC(=C2)NC(=O)CCl)C(=O)OC

InChI

InChI=1S/C18H19ClN2O4/c1-24-16-7-12(6-13(8-16)18(23)25-2)11-20-14-4-3-5-15(9-14)21-17(22)10-19/h3-9,20H,10-11H2,1-2H3,(H,21,22)