2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)ethanoyl]amino]-N-cyclohexyl-2-(4-dimethylaminophenyl)ethanamide

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)ethanoyl]amino]-N-cyclohexyl-2-(4-dimethylaminophenyl)ethanamide Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)acetyl]amino]-N-cyclohexyl-2-(4-dimethylaminophenyl)acetamide CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(1-benzotriazolyl)-1-oxoethyl]amino]-N-cyclohexyl-2-(4-dimethylaminophenyl)acetamide IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl-[2-(benzotriazol-1-yl)acetyl]amino]-N-cyclohexyl-2-(4-dimethylaminophenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-piperonyl-amino]-N-cyclohexyl-2-(4-dimethylaminophenyl)acetamide Formula: C32H36N6O4 MolecularWeight: 568.66604

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CN5C6=CC=CC=C6N=N5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(CC3=CC4=C(C=C3)OCO4)C(=O)CN5C6=CC=CC=C6N=N5

InChI

InChI=1S/C32H36N6O4/c1-36(2)25-15-13-23(14-16-25)31(32(40)33-24-8-4-3-5-9-24)37(19-22-12-17-28-29(18-22)42-21-41-28)30(39)20-38-27-11-7-6-10-26(27)34-35-38/h6-7,10-18,24,31H,3-5,8-9,19-21H2,1-2H3,(H,33,40)