(4-nitrophenyl)methyl (2R)-3-methyl-2-[4-oxidanylidene-5-(triphenylmethyl)imino-1,3-thiazolidin-3-yl]but-3-enoate

Systemtic Name: (4-nitrophenyl)methyl (2R)-3-methyl-2-[4-oxidanylidene-5-(triphenylmethyl)imino-1,3-thiazolidin-3-yl]but-3-enoate Openeye Name: (4-nitrophenyl)methyl (2R)-3-methyl-2-(4-oxo-5-tritylimino-thiazolidin-3-yl)but-3-enoate CAS Name: (2R)-3-methyl-2-[4-oxo-5-(triphenylmethyl)imino-3-thiazolidinyl]-3-butenoic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl (2R)-3-methyl-2-(4-oxo-5-tritylimino-1,3-thiazolidin-3-yl)but-3-enoate Traditional Name: (2R)-2-(4-keto-5-tritylimino-thiazolidin-3-yl)-3-methyl-but-3-enoic acid (4-nitrobenzyl) ester Formula: C34H29N3O5S MolecularWeight: 591.67616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2CSC(=NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C2=O

Isomeric SMILES

CC(=C)[C@H](C(=O)OCC1=CC=C(C=C1)[N+](=O)[O-])N2CSC(=NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C2=O

InChI

InChI=1S/C34H29N3O5S/c1-24(2)30(33(39)42-22-25-18-20-29(21-19-25)37(40)41)36-23-43-31(32(36)38)35-34(26-12-6-3-7-13-26,27-14-8-4-9-15-27)28-16-10-5-11-17-28/h3-21,30H,1,22-23H2,2H3/t30-/m1/s1