2-[3-[(9-diazanyl-9-oxidanylidene-nonanoyl)-methyl-amino]-2-oxidanyl-5-(2-phenylpropan-2-yl)phenyl]benzotriazole-5-carboxamide

Systemtic Name: 2-[3-[(9-diazanyl-9-oxidanylidene-nonanoyl)-methyl-amino]-2-oxidanyl-5-(2-phenylpropan-2-yl)phenyl]benzotriazole-5-carboxamide Openeye Name: 2-[3-[(9-hydrazino-9-oxo-nonanoyl)-methyl-amino]-2-hydroxy-5-(1-methyl-1-phenyl-ethyl)phenyl]benzotriazole-5-carboxamide CAS Name: 2-[3-[(9-hydrazinyl-1,9-dioxononyl)-methylamino]-2-hydroxy-5-(2-phenylpropan-2-yl)phenyl]-5-benzotriazolecarboxamide IUPAC Name: 2-[3-[(9-hydrazinyl-9-oxononanoyl)-methylamino]-2-hydroxy-5-(2-phenylpropan-2-yl)phenyl]benzotriazole-5-carboxamide Traditional Name: 2-[5-cumyl-3-[(9-hydrazino-9-keto-nonanoyl)-methyl-amino]-2-hydroxy-phenyl]benzotriazole-5-carboxamide Formula: C32H39N7O4 MolecularWeight: 585.69656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC(=C(C(=C2)N(C)C(=O)CCCCCCCC(=O)NN)O)N3N=C4C=CC(=CC4=N3)C(=O)N

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC(=C(C(=C2)N(C)C(=O)CCCCCCCC(=O)NN)O)N3N=C4C=CC(=CC4=N3)C(=O)N

InChI

InChI=1S/C32H39N7O4/c1-32(2,22-12-8-7-9-13-22)23-19-26(38(3)29(41)15-11-6-4-5-10-14-28(40)35-34)30(42)27(20-23)39-36-24-17-16-21(31(33)43)18-25(24)37-39/h7-9,12-13,16-20,42H,4-6,10-11,14-15,34H2,1-3H3,(H2,33,43)(H,35,40)