[[4-(1,3-benzoxazol-2-ylmethoxy)-2-methyl-phenyl]-methoxycarbonyl-amino]methyl thiophene-2-carboxylate

Systemtic Name: [[4-(1,3-benzoxazol-2-ylmethoxy)-2-methyl-phenyl]-methoxycarbonyl-amino]methyl thiophene-2-carboxylate Openeye Name: [4-(1,3-benzoxazol-2-ylmethoxy)-N-methoxycarbonyl-2-methyl-anilino]methyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-(1,3-benzoxazol-2-ylmethoxy)-N-methoxycarbonyl-2-methylanilino]methyl ester IUPAC Name: [4-(1,3-benzoxazol-2-ylmethoxy)-N-methoxycarbonyl-2-methylanilino]methyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-(1,3-benzoxazol-2-ylmethoxy)-N-carbomethoxy-2-methyl-anilino]methyl ester Formula: C23H20N2O6S MolecularWeight: 452.4797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3O2)N(COC(=O)C4=CC=CS4)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3O2)N(COC(=O)C4=CC=CS4)C(=O)OC

InChI

InChI=1S/C23H20N2O6S/c1-15-12-16(29-13-21-24-17-6-3-4-7-19(17)31-21)9-10-18(15)25(23(27)28-2)14-30-22(26)20-8-5-11-32-20/h3-12H,13-14H2,1-2H3