tert-butyl 5-(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)oxy-2,3-dimethyl-indole-1-carboxylate

Systemtic Name: tert-butyl 5-(6-methoxy-7-phenylmethoxy-quinazolin-4-yl)oxy-2,3-dimethyl-indole-1-carboxylate Openeye Name: tert-butyl 5-(7-benzyloxy-6-methoxy-quinazolin-4-yl)oxy-2,3-dimethyl-indole-1-carboxylate CAS Name: 5-[(6-methoxy-7-phenylmethoxy-4-quinazolinyl)oxy]-2,3-dimethyl-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(6-methoxy-7-phenylmethoxyquinazolin-4-yl)oxy-2,3-dimethylindole-1-carboxylate Traditional Name: 5-(7-benzoxy-6-methoxy-quinazolin-4-yl)oxy-2,3-dimethyl-indole-1-carboxylic acid tert-butyl ester Formula: C31H31N3O5 MolecularWeight: 525.59494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OCC5=CC=CC=C5)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)OC3=NC=NC4=CC(=C(C=C43)OC)OCC5=CC=CC=C5)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C31H31N3O5/c1-19-20(2)34(30(35)39-31(3,4)5)26-13-12-22(14-23(19)26)38-29-24-15-27(36-6)28(16-25(24)32-18-33-29)37-17-21-10-8-7-9-11-21/h7-16,18H,17H2,1-6H3