methyl 3-[[2,4-bis(oxidanyl)phenyl]methylamino]-2-methyl-benzoate

Systemtic Name: methyl 3-[[2,4-bis(oxidanyl)phenyl]methylamino]-2-methyl-benzoate Openeye Name: methyl 3-[(2,4-dihydroxyphenyl)methylamino]-2-methyl-benzoate CAS Name: 3-[(2,4-dihydroxyphenyl)methylamino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(2,4-dihydroxyphenyl)methylamino]-2-methylbenzoate Traditional Name: 3-[(2,4-dihydroxybenzyl)amino]-2-methyl-benzoic acid methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC2=C(C=C(C=C2)O)O)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NCC2=C(C=C(C=C2)O)O)C(=O)OC

InChI

InChI=1S/C16H17NO4/c1-10-13(16(20)21-2)4-3-5-14(10)17-9-11-6-7-12(18)8-15(11)19/h3-8,17-19H,9H2,1-2H3