[2-methyl-3-(4-nitrophenyl)-4-oxidanylidene-chromen-7-yl] (2R)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: [2-methyl-3-(4-nitrophenyl)-4-oxidanylidene-chromen-7-yl] (2R)-2-[(4-methylphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: [2-methyl-3-(4-nitrophenyl)-4-oxo-chromen-7-yl] (2R)-3-phenyl-2-(p-tolylsulfonylamino)propanoate CAS Name: (2R)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoic acid [2-methyl-3-(4-nitrophenyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [2-methyl-3-(4-nitrophenyl)-4-oxochromen-7-yl] (2R)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2R)-3-phenyl-2-(tosylamino)propionic acid [4-keto-2-methyl-3-(4-nitrophenyl)chromen-7-yl] ester Formula: C32H26N2O8S MolecularWeight: 598.62244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H](CC2=CC=CC=C2)C(=O)OC3=CC4=C(C=C3)C(=O)C(=C(O4)C)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C32H26N2O8S/c1-20-8-15-26(16-9-20)43(39,40)33-28(18-22-6-4-3-5-7-22)32(36)42-25-14-17-27-29(19-25)41-21(2)30(31(27)35)23-10-12-24(13-11-23)34(37)38/h3-17,19,28,33H,18H2,1-2H3/t28-/m1/s1