N-[1-(cyclohexylmethyl)piperidin-4-yl]-6-ethoxy-1-(phenylcarbonyl)benzotriazole-5-carboxamide

Systemtic Name: N-[1-(cyclohexylmethyl)piperidin-4-yl]-6-ethoxy-1-(phenylcarbonyl)benzotriazole-5-carboxamide Openeye Name: 1-benzoyl-N-[1-(cyclohexylmethyl)-4-piperidyl]-6-ethoxy-benzotriazole-5-carboxamide CAS Name: 1-benzoyl-N-[1-(cyclohexylmethyl)-4-piperidinyl]-6-ethoxy-5-benzotriazolecarboxamide IUPAC Name: 1-benzoyl-N-[1-(cyclohexylmethyl)piperidin-4-yl]-6-ethoxybenzotriazole-5-carboxamide Traditional Name: 1-benzoyl-N-[1-(cyclohexylmethyl)-4-piperidyl]-6-ethoxy-benzotriazole-5-carboxamide Formula: C28H35N5O3 MolecularWeight: 489.6092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C(=O)NC3CCN(CC3)CC4CCCCC4)N=NN2C(=O)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1C(=O)NC3CCN(CC3)CC4CCCCC4)N=NN2C(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H35N5O3/c1-2-36-26-18-25-24(30-31-33(25)28(35)21-11-7-4-8-12-21)17-23(26)27(34)29-22-13-15-32(16-14-22)19-20-9-5-3-6-10-20/h4,7-8,11-12,17-18,20,22H,2-3,5-6,9-10,13-16,19H2,1H3,(H,29,34)