(2,6-dimethyl-4-phenylmethoxycarbonyl-phenyl) 1,1-dimethylbenzo[e]indole-2-carboxylate

Systemtic Name: (2,6-dimethyl-4-phenylmethoxycarbonyl-phenyl) 1,1-dimethylbenzo[e]indole-2-carboxylate Openeye Name: (4-benzyloxycarbonyl-2,6-dimethyl-phenyl) 1,1-dimethylbenzo[e]indole-2-carboxylate CAS Name: 1,1-dimethyl-2-benzo[e]indolecarboxylic acid (2,6-dimethyl-4-phenylmethoxycarbonylphenyl) ester IUPAC Name: (2,6-dimethyl-4-phenylmethoxycarbonylphenyl) 1,1-dimethylbenzo[e]indole-2-carboxylate Traditional Name: 1,1-dimethylbenz[e]indole-2-carboxylic acid (4-carbobenzoxy-2,6-dimethyl-phenyl) ester Formula: C31H27NO4 MolecularWeight: 477.55038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC(=O)C2=NC3=C(C2(C)C)C4=CC=CC=C4C=C3)C)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC(=C1OC(=O)C2=NC3=C(C2(C)C)C4=CC=CC=C4C=C3)C)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C31H27NO4/c1-19-16-23(29(33)35-18-21-10-6-5-7-11-21)17-20(2)27(19)36-30(34)28-31(3,4)26-24-13-9-8-12-22(24)14-15-25(26)32-28/h5-17H,18H2,1-4H3