N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[2-(cyclohexylamino)-2-oxidanylidene-1-phenyl-ethyl]-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[2-(cyclohexylamino)-2-oxo-1-phenyl-ethyl]-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-(3-pyridinylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[2-(cyclohexylamino)-2-oxo-1-phenylethyl]-N-(pyridin-3-ylmethyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[2-(cyclohexylamino)-2-keto-1-phenyl-ethyl]-N-(3-pyridylmethyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(CC3=CN=CC=C3)C(=O)C4COC5=CC=CC=C5O4

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=CC=C2)N(CC3=CN=CC=C3)C(=O)C4COC5=CC=CC=C5O4

InChI

InChI=1S/C29H31N3O4/c33-28(31-23-13-5-2-6-14-23)27(22-11-3-1-4-12-22)32(19-21-10-9-17-30-18-21)29(34)26-20-35-24-15-7-8-16-25(24)36-26/h1,3-4,7-12,15-18,23,26-27H,2,5-6,13-14,19-20H2,(H,31,33)