tert-butyl 3,7-bis[(2-methylpropan-2-yl)oxycarbonyl-phenyl-amino]phenoxazine-10-carboxylate

Systemtic Name: tert-butyl 3,7-bis[(2-methylpropan-2-yl)oxycarbonyl-phenyl-amino]phenoxazine-10-carboxylate Openeye Name: tert-butyl 3,7-bis(N-tert-butoxycarbonylanilino)phenoxazine-10-carboxylate CAS Name: 3,7-bis(N-[(2-methylpropan-2-yl)oxy-oxomethyl]anilino)-10-phenoxazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3,7-bis[N-[(2-methylpropan-2-yl)oxycarbonyl]anilino]phenoxazine-10-carboxylate Traditional Name: 3,7-bis(N-tert-butoxycarbonylanilino)phenoxazine-10-carboxylic acid tert-butyl ester Formula: C39H43N3O7 MolecularWeight: 665.77462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)N(C3=CC=CC=C3)C(=O)OC(C)(C)C)OC4=C1C=CC(=C4)N(C5=CC=CC=C5)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)N(C3=CC=CC=C3)C(=O)OC(C)(C)C)OC4=C1C=CC(=C4)N(C5=CC=CC=C5)C(=O)OC(C)(C)C

InChI

InChI=1S/C39H43N3O7/c1-37(2,3)47-34(43)40(26-16-12-10-13-17-26)28-20-22-30-32(24-28)46-33-25-29(21-23-31(33)42(30)36(45)49-39(7,8)9)41(27-18-14-11-15-19-27)35(44)48-38(4,5)6/h10-25H,1-9H3