[1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate

Systemtic Name: [1-[(2,6-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Openeye Name: [2-(2,6-dimethylanilino)-1-methyl-2-oxo-ethyl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate CAS Name: 8-(1,3-benzoxazol-2-yl)-1-naphthalenecarboxylic acid [1-(2,6-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,6-dimethylanilino)-1-oxopropan-2-yl] 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylate Traditional Name: 8-(1,3-benzoxazol-2-yl)naphthalene-1-carboxylic acid [2-(2,6-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C29H24N2O4 MolecularWeight: 464.51186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(C)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C(C)OC(=O)C2=CC=CC3=C2C(=CC=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C29H24N2O4/c1-17-9-6-10-18(2)26(17)31-27(32)19(3)34-29(33)22-14-8-12-20-11-7-13-21(25(20)22)28-30-23-15-4-5-16-24(23)35-28/h4-16,19H,1-3H3,(H,31,32)