methyl 2-azanyl-3-[(2-azanyl-3-methoxycarbonyl-phenyl)methyl]benzoate

Systemtic Name: methyl 2-azanyl-3-[(2-azanyl-3-methoxycarbonyl-phenyl)methyl]benzoate Openeye Name: methyl 2-amino-3-[(2-amino-3-methoxycarbonyl-phenyl)methyl]benzoate CAS Name: 2-amino-3-[(2-amino-3-methoxycarbonylphenyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 2-amino-3-[(2-amino-3-methoxycarbonylphenyl)methyl]benzoate Traditional Name: 2-amino-3-(2-amino-3-carbomethoxy-benzyl)benzoic acid methyl ester Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)CC2=CC=CC(=C2N)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)CC2=CC=CC(=C2N)C(=O)OC)N

InChI

InChI=1S/C17H18N2O4/c1-22-16(20)12-7-3-5-10(14(12)18)9-11-6-4-8-13(15(11)19)17(21)23-2/h3-8H,9,18-19H2,1-2H3