(phenylmethyl) 4-[[(2,2-dimethyl-4-oxidanylidene-1,3-benzodioxin-6-yl)amino]methyl]benzoate

Systemtic Name: (phenylmethyl) 4-[[(2,2-dimethyl-4-oxidanylidene-1,3-benzodioxin-6-yl)amino]methyl]benzoate Openeye Name: benzyl 4-[[(2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)amino]methyl]benzoate CAS Name: 4-[[(2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)amino]methyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[(2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)amino]methyl]benzoate Traditional Name: 4-[[(4-keto-2,2-dimethyl-1,3-benzodioxin-6-yl)amino]methyl]benzoic acid benzyl ester Formula: C25H23NO5 MolecularWeight: 417.45382

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(C=C(C=C2)NCC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C(=O)O1)C

Isomeric SMILES

CC1(OC2=C(C=C(C=C2)NCC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C(=O)O1)C

InChI

InChI=1S/C25H23NO5/c1-25(2)30-22-13-12-20(14-21(22)24(28)31-25)26-15-17-8-10-19(11-9-17)23(27)29-16-18-6-4-3-5-7-18/h3-14,26H,15-16H2,1-2H3