ethyl 4-[(4-nitrophenyl)sulfanyl-$l^{2}-azanyl]-3,5-diphenyl-benzoate

Systemtic Name: ethyl 4-[(4-nitrophenyl)sulfanyl-$l^{2}-azanyl]-3,5-diphenyl-benzoate Openeye Name: ethyl 4-[(4-nitrophenyl)sulfanyl-$l^{2}-azanyl]-3,5-diphenyl-benzoate CAS Name: 4-[[(4-nitrophenyl)thio]-$l^{2}-azanyl]-3,5-diphenylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-nitrophenyl)sulfanyl-$l^{2}-azanyl]-3,5-diphenylbenzoate Traditional Name: 4-[[(4-nitrophenyl)thio]-$l^{2}-azanyl]-3,5-diphenyl-benzoic acid ethyl ester Formula: C27H21N2O4S MolecularWeight: 469.53164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1)C2=CC=CC=C2)[N]SC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1)C2=CC=CC=C2)[N]SC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C27H21N2O4S/c1-2-33-27(30)21-17-24(19-9-5-3-6-10-19)26(25(18-21)20-11-7-4-8-12-20)28-34-23-15-13-22(14-16-23)29(31)32/h3-18H,2H2,1H3