(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate CAS Name: 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate Traditional Name: 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propionic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C27H27NO6S MolecularWeight: 493.57138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)NC(C)C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)NC(C)C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)C)C

InChI

InChI=1S/C27H27NO6S/c1-15-12-16(2)18(4)26(17(15)3)35(31,32)28-19(5)27(30)33-14-21-13-24(29)34-23-11-10-20-8-6-7-9-22(20)25(21)23/h6-13,19,28H,14H2,1-5H3