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

Systemtic Name: (phenylmethyl) 4-[[3-cyclopropylpropanoyl-(2,2-dimethyl-4-oxidanylidene-1,3-benzodioxin-6-yl)amino]methyl]benzoate Openeye Name: benzyl 4-[[3-cyclopropylpropanoyl-(2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)amino]methyl]benzoate CAS Name: 4-[[(3-cyclopropyl-1-oxopropyl)-(2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)amino]methyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[3-cyclopropylpropanoyl-(2,2-dimethyl-4-oxo-1,3-benzodioxin-6-yl)amino]methyl]benzoate Traditional Name: 4-[[3-cyclopropylpropanoyl-(4-keto-2,2-dimethyl-1,3-benzodioxin-6-yl)amino]methyl]benzoic acid benzyl ester Formula: C31H31NO6 MolecularWeight: 513.58094

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(C=C(C=C2)N(CC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C(=O)CCC5CC5)C(=O)O1)C

Isomeric SMILES

CC1(OC2=C(C=C(C=C2)N(CC3=CC=C(C=C3)C(=O)OCC4=CC=CC=C4)C(=O)CCC5CC5)C(=O)O1)C

InChI

InChI=1S/C31H31NO6/c1-31(2)37-27-16-15-25(18-26(27)30(35)38-31)32(28(33)17-12-21-8-9-21)19-22-10-13-24(14-11-22)29(34)36-20-23-6-4-3-5-7-23/h3-7,10-11,13-16,18,21H,8-9,12,17,19-20H2,1-2H3