4-[4-[3-[[3-(2H-benzotriazol-4-yloxy)-2-oxidanyl-propyl]amino]-3-methyl-butyl]phenoxy]benzamide

Systemtic Name: 4-[4-[3-[[3-(2H-benzotriazol-4-yloxy)-2-oxidanyl-propyl]amino]-3-methyl-butyl]phenoxy]benzamide Openeye Name: 4-[4-[3-[[3-(2H-benzotriazol-4-yloxy)-2-hydroxy-propyl]amino]-3-methyl-butyl]phenoxy]benzamide CAS Name: 4-[4-[3-[[3-(2H-benzotriazol-4-yloxy)-2-hydroxypropyl]amino]-3-methylbutyl]phenoxy]benzamide IUPAC Name: 4-[4-[3-[[3-(2H-benzotriazol-4-yloxy)-2-hydroxypropyl]amino]-3-methylbutyl]phenoxy]benzamide Traditional Name: 4-[4-[3-[[3-(2H-benzotriazol-4-yloxy)-2-hydroxy-propyl]amino]-3-methyl-butyl]phenoxy]benzamide Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)N)NCC(COC3=CC=CC4=NNN=C43)O

Isomeric SMILES

CC(C)(CCC1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)N)NCC(COC3=CC=CC4=NNN=C43)O

InChI

InChI=1S/C27H31N5O4/c1-27(2,29-16-20(33)17-35-24-5-3-4-23-25(24)31-32-30-23)15-14-18-6-10-21(11-7-18)36-22-12-8-19(9-13-22)26(28)34/h3-13,20,29,33H,14-17H2,1-2H3,(H2,28,34)(H,30,31,32)