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

Systemtic Name: N1,N3-bis[[3-(benzotriazol-2-yl)-5-ethyl-2-oxidanyl-phenyl]methyl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[[3-(benzotriazol-2-yl)-5-ethyl-2-hydroxy-phenyl]methyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[[3-(2-benzotriazolyl)-5-ethyl-2-hydroxyphenyl]methyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[[3-(benzotriazol-2-yl)-5-ethyl-2-hydroxyphenyl]methyl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[3-(benzotriazol-2-yl)-5-ethyl-2-hydroxy-benzyl]isophthalamide Formula: C38H34N8O4 MolecularWeight: 666.72776

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)CNC(=O)C4=CC(=CC=C4)C(=O)NCC5=C(C(=CC(=C5)CC)N6N=C7C=CC=CC7=N6)O

Isomeric SMILES

CCC1=CC(=C(C(=C1)N2N=C3C=CC=CC3=N2)O)CNC(=O)C4=CC(=CC=C4)C(=O)NCC5=C(C(=CC(=C5)CC)N6N=C7C=CC=CC7=N6)O

InChI

InChI=1S/C38H34N8O4/c1-3-23-16-27(35(47)33(18-23)45-41-29-12-5-6-13-30(29)42-45)21-39-37(49)25-10-9-11-26(20-25)38(50)40-22-28-17-24(4-2)19-34(36(28)48)46-43-31-14-7-8-15-32(31)44-46/h5-20,47-48H,3-4,21-22H2,1-2H3,(H,39,49)(H,40,50)