2-phenoxy-N-[6-[4-(2-phenoxyethanoyl)-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide

Systemtic Name: 2-phenoxy-N-[6-[4-(2-phenoxyethanoyl)-1,4-diazepan-1-yl]pyridin-3-yl]ethanamide Openeye Name: 2-phenoxy-N-[6-[4-(2-phenoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]acetamide CAS Name: N-[6-[4-(1-oxo-2-phenoxyethyl)-1,4-diazepan-1-yl]-3-pyridinyl]-2-phenoxyacetamide IUPAC Name: 2-phenoxy-N-[6-[4-(2-phenoxyacetyl)-1,4-diazepan-1-yl]pyridin-3-yl]acetamide Traditional Name: 2-phenoxy-N-[6-[4-(2-phenoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]acetamide Formula: C26H28N4O4 MolecularWeight: 460.52492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)COC2=CC=CC=C2)C3=NC=C(C=C3)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)COC2=CC=CC=C2)C3=NC=C(C=C3)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C26H28N4O4/c31-25(19-33-22-8-3-1-4-9-22)28-21-12-13-24(27-18-21)29-14-7-15-30(17-16-29)26(32)20-34-23-10-5-2-6-11-23/h1-6,8-13,18H,7,14-17,19-20H2,(H,28,31)