(2,6-dimethyl-4-phenylmethoxycarbonyl-phenyl) 2-[(E)-2-(4-methoxyphenyl)ethenyl]acridine-9-carboxylate

Systemtic Name: (2,6-dimethyl-4-phenylmethoxycarbonyl-phenyl) 2-[(E)-2-(4-methoxyphenyl)ethenyl]acridine-9-carboxylate Openeye Name: (4-benzyloxycarbonyl-2,6-dimethyl-phenyl) 2-[(E)-2-(4-methoxyphenyl)vinyl]acridine-9-carboxylate CAS Name: 2-[(E)-2-(4-methoxyphenyl)ethenyl]-9-acridinecarboxylic acid (2,6-dimethyl-4-phenylmethoxycarbonylphenyl) ester IUPAC Name: (2,6-dimethyl-4-phenylmethoxycarbonylphenyl) 2-[(E)-2-(4-methoxyphenyl)ethenyl]acridine-9-carboxylate Traditional Name: 2-[(E)-2-(4-methoxyphenyl)vinyl]acridine-9-carboxylic acid (4-carbobenzoxy-2,6-dimethyl-phenyl) ester Formula: C39H31NO5 MolecularWeight: 593.66714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=NC4=CC=CC=C42)C=CC5=CC=C(C=C5)OC)C)C(=O)OCC6=CC=CC=C6

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=C3C=C(C=CC3=NC4=CC=CC=C42)/C=C/C5=CC=C(C=C5)OC)C)C(=O)OCC6=CC=CC=C6

InChI

InChI=1S/C39H31NO5/c1-25-21-30(38(41)44-24-29-9-5-4-6-10-29)22-26(2)37(25)45-39(42)36-32-11-7-8-12-34(32)40-35-20-17-28(23-33(35)36)14-13-27-15-18-31(43-3)19-16-27/h4-23H,24H2,1-3H3/b14-13+