N1,N3-bis[[3-(benzotriazol-2-yl)-2-oxidanyl-5-propan-2-yl-phenyl]methyl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[[3-(benzotriazol-2-yl)-2-oxidanyl-5-propan-2-yl-phenyl]methyl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[[3-(benzotriazol-2-yl)-2-hydroxy-5-isopropyl-phenyl]methyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[[3-(2-benzotriazolyl)-2-hydroxy-5-propan-2-ylphenyl]methyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[[3-(benzotriazol-2-yl)-2-hydroxy-5-propan-2-ylphenyl]methyl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[3-(benzotriazol-2-yl)-2-hydroxy-5-isopropyl-benzyl]isophthalamide Formula: C40H38N8O4 MolecularWeight: 694.78092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)CNC(=O)C4=CC(=CC=C4)C(=O)NCC5=C(C(=CC(=C5)C(C)C)N6N=C7C=CC=CC7=N6)O

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)CNC(=O)C4=CC(=CC=C4)C(=O)NCC5=C(C(=CC(=C5)C(C)C)N6N=C7C=CC=CC7=N6)O

InChI

InChI=1S/C40H38N8O4/c1-23(2)27-17-29(37(49)35(19-27)47-43-31-12-5-6-13-32(31)44-47)21-41-39(51)25-10-9-11-26(16-25)40(52)42-22-30-18-28(24(3)4)20-36(38(30)50)48-45-33-14-7-8-15-34(33)46-48/h5-20,23-24,49-50H,21-22H2,1-4H3,(H,41,51)(H,42,52)