N1-(2,7-ditert-butyl-9,9-dimethyl-5-phenyldiazenyl-xanthen-4-yl)-N4,N4-diethyl-benzene-1,4-dicarboxamide

Systemtic Name: N1-(2,7-ditert-butyl-9,9-dimethyl-5-phenyldiazenyl-xanthen-4-yl)-N4,N4-diethyl-benzene-1,4-dicarboxamide Openeye Name: N1-(2,7-ditert-butyl-9,9-dimethyl-5-phenylazo-xanthen-4-yl)-N4,N4-diethyl-terephthalamide CAS Name: N1-(2,7-ditert-butyl-9,9-dimethyl-5-phenyldiazenyl-4-xanthenyl)-N4,N4-diethylbenzene-1,4-dicarboxamide IUPAC Name: 1-N-(2,7-ditert-butyl-9,9-dimethyl-5-phenyldiazenylxanthen-4-yl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide Traditional Name: N-(2,7-ditert-butyl-9,9-dimethyl-5-phenylazo-xanthen-4-yl)-N',N'-diethyl-terephthalamide Formula: C41H48N4O3 MolecularWeight: 644.84482

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)C(C)(C)C)C(C4=CC(=CC(=C4O3)N=NC5=CC=CC=C5)C(C)(C)C)(C)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)C(C)(C)C)C(C4=CC(=CC(=C4O3)N=NC5=CC=CC=C5)C(C)(C)C)(C)C

InChI

InChI=1S/C41H48N4O3/c1-11-45(12-2)38(47)27-20-18-26(19-21-27)37(46)42-33-24-28(39(3,4)5)22-31-35(33)48-36-32(41(31,9)10)23-29(40(6,7)8)25-34(36)44-43-30-16-14-13-15-17-30/h13-25H,11-12H2,1-10H3,(H,42,46)