1-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-N-(2,4-dimethoxyphenyl)cyclohexane-1-carboxamide

Systemtic Name: 1-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-N-(2,4-dimethoxyphenyl)cyclohexane-1-carboxamide Openeye Name: 1-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-(2,4-dimethoxyphenyl)cyclohexanecarboxamide CAS Name: 1-[[2-(1-benzotriazolyl)-1-oxoethyl]-(phenylmethyl)amino]-N-(2,4-dimethoxyphenyl)-1-cyclohexanecarboxamide IUPAC Name: 1-[[2-(benzotriazol-1-yl)acetyl]-benzylamino]-N-(2,4-dimethoxyphenyl)cyclohexane-1-carboxamide Traditional Name: 1-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-(2,4-dimethoxyphenyl)cyclohexanecarboxamide Formula: C30H33N5O4 MolecularWeight: 527.61412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2(CCCCC2)N(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2(CCCCC2)N(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4)OC

InChI

InChI=1S/C30H33N5O4/c1-38-23-15-16-25(27(19-23)39-2)31-29(37)30(17-9-4-10-18-30)34(20-22-11-5-3-6-12-22)28(36)21-35-26-14-8-7-13-24(26)32-33-35/h3,5-8,11-16,19H,4,9-10,17-18,20-21H2,1-2H3,(H,31,37)