9-[(4-tert-butylphenyl)methyl]-6-phenylmethoxy-1H-pyrano[3,4-b]indole-3,4-dione

Systemtic Name: 9-[(4-tert-butylphenyl)methyl]-6-phenylmethoxy-1H-pyrano[3,4-b]indole-3,4-dione Openeye Name: 6-benzyloxy-9-[(4-tert-butylphenyl)methyl]-1H-pyrano[3,4-b]indole-3,4-dione CAS Name: 9-[(4-tert-butylphenyl)methyl]-6-phenylmethoxy-1H-pyrano[3,4-b]indole-3,4-dione IUPAC Name: 9-[(4-tert-butylphenyl)methyl]-6-phenylmethoxy-1H-pyrano[3,4-b]indole-3,4-dione Traditional Name: 6-benzoxy-9-(4-tert-butylbenzyl)-1H-pyran[3,4-b]indole-3,4-quinone Formula: C29H27NO4 MolecularWeight: 453.52898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2C3=C(C4=C2C=CC(=C4)OCC5=CC=CC=C5)C(=O)C(=O)OC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2C3=C(C4=C2C=CC(=C4)OCC5=CC=CC=C5)C(=O)C(=O)OC3

InChI

InChI=1S/C29H27NO4/c1-29(2,3)21-11-9-19(10-12-21)16-30-24-14-13-22(33-17-20-7-5-4-6-8-20)15-23(24)26-25(30)18-34-28(32)27(26)31/h4-15H,16-18H2,1-3H3