N-cyclohexyl-2-[2-hydroxyethyl-(phenylmethyl)amino]-2-(6-nitro-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: N-cyclohexyl-2-[2-hydroxyethyl-(phenylmethyl)amino]-2-(6-nitro-1,3-benzodioxol-5-yl)ethanamide Openeye Name: 2-[benzyl(2-hydroxyethyl)amino]-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide CAS Name: N-cyclohexyl-2-[2-hydroxyethyl-(phenylmethyl)amino]-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-[benzyl(2-hydroxyethyl)amino]-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-[benzyl(2-hydroxyethyl)amino]-N-cyclohexyl-2-(6-nitro-1,3-benzodioxol-5-yl)acetamide Formula: C24H29N3O6 MolecularWeight: 455.50356

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)N(CCO)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC3=C(C=C2[N+](=O)[O-])OCO3)N(CCO)CC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O6/c28-12-11-26(15-17-7-3-1-4-8-17)23(24(29)25-18-9-5-2-6-10-18)19-13-21-22(33-16-32-21)14-20(19)27(30)31/h1,3-4,7-8,13-14,18,23,28H,2,5-6,9-12,15-16H2,(H,25,29)