N-(1,3-benzodioxol-5-yl)-2-methyl-2-[2-phenylethanoyl(pyridin-3-ylmethyl)amino]butanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[2-phenylethanoyl(pyridin-3-ylmethyl)amino]butanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(2-phenylacetyl)-(3-pyridylmethyl)amino]butanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(1-oxo-2-phenylethyl)-(3-pyridinylmethyl)amino]butanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(2-phenylacetyl)-(pyridin-3-ylmethyl)amino]butanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(2-phenylacetyl)-(3-pyridylmethyl)amino]butyramide Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)NC1=CC2=C(C=C1)OCO2)N(CC3=CN=CC=C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CCC(C)(C(=O)NC1=CC2=C(C=C1)OCO2)N(CC3=CN=CC=C3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4/c1-3-26(2,25(31)28-21-11-12-22-23(15-21)33-18-32-22)29(17-20-10-7-13-27-16-20)24(30)14-19-8-5-4-6-9-19/h4-13,15-16H,3,14,17-18H2,1-2H3,(H,28,31)