[1-[(4-ethoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1,3-benzoxazol-2-yl)benzoate

Systemtic Name: [1-[(4-ethoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(1,3-benzoxazol-2-yl)benzoate Openeye Name: 1-[(4-ethoxycarbonylphenyl)carbamoyl]propyl 2-(1,3-benzoxazol-2-yl)benzoate CAS Name: 2-(1,3-benzoxazol-2-yl)benzoic acid [1-(4-ethoxycarbonylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-ethoxycarbonylanilino)-1-oxobutan-2-yl] 2-(1,3-benzoxazol-2-yl)benzoate Traditional Name: 2-(1,3-benzoxazol-2-yl)benzoic acid 1-[(4-carbethoxyphenyl)carbamoyl]propyl ester Formula: C27H24N2O6 MolecularWeight: 472.48926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4O3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)OC(=O)C2=CC=CC=C2C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C27H24N2O6/c1-3-22(24(30)28-18-15-13-17(14-16-18)26(31)33-4-2)35-27(32)20-10-6-5-9-19(20)25-29-21-11-7-8-12-23(21)34-25/h5-16,22H,3-4H2,1-2H3,(H,28,30)