N'-(2-aminophenyl)-N-[3-(1-phenyl-1,2,3-triazol-4-yl)phenyl]octanediamide

Systemtic Name: N'-(2-aminophenyl)-N-[3-(1-phenyl-1,2,3-triazol-4-yl)phenyl]octanediamide Openeye Name: N'-(2-aminophenyl)-N-[3-(1-phenyltriazol-4-yl)phenyl]octanediamide CAS Name: N'-(2-aminophenyl)-N-[3-(1-phenyl-4-triazolyl)phenyl]octanediamide IUPAC Name: N'-(2-aminophenyl)-N-[3-(1-phenyltriazol-4-yl)phenyl]octanediamide Traditional Name: N'-(2-aminophenyl)-N-[3-(1-phenyltriazol-4-yl)phenyl]suberamide Formula: C28H30N6O2 MolecularWeight: 482.5768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(N=N2)C3=CC(=CC=C3)NC(=O)CCCCCCC(=O)NC4=CC=CC=C4N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(N=N2)C3=CC(=CC=C3)NC(=O)CCCCCCC(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C28H30N6O2/c29-24-15-8-9-16-25(24)31-28(36)18-7-2-1-6-17-27(35)30-22-12-10-11-21(19-22)26-20-34(33-32-26)23-13-4-3-5-14-23/h3-5,8-16,19-20H,1-2,6-7,17-18,29H2,(H,30,35)(H,31,36)