(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(3-methoxyphenyl)methylamino]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(3-methoxyphenyl)methylamino]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(3-methoxyphenyl)methylamino]benzoate CAS Name: 2-[(3-methoxyphenyl)methylamino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(3-methoxyphenyl)methylamino]benzoate Traditional Name: 2-(m-anisylamino)benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NCC2=CC(=CC=C2)OC

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NCC2=CC(=CC=C2)OC

InChI

InChI=1S/C21H25NO4/c1-21(2,3)19(23)14-26-20(24)17-10-5-6-11-18(17)22-13-15-8-7-9-16(12-15)25-4/h5-12,22H,13-14H2,1-4H3