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

Systemtic Name: N-[6-[4-(2-methoxyethanoyl)-1,4-diazepan-1-yl]pyridin-3-yl]-2-phenoxy-ethanamide Openeye Name: N-[6-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-phenoxy-acetamide CAS Name: N-[6-[4-(2-methoxy-1-oxoethyl)-1,4-diazepan-1-yl]-3-pyridinyl]-2-phenoxyacetamide IUPAC Name: N-[6-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]pyridin-3-yl]-2-phenoxyacetamide Traditional Name: N-[6-[4-(2-methoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-phenoxy-acetamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCCN(CC1)C2=NC=C(C=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

COCC(=O)N1CCCN(CC1)C2=NC=C(C=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4/c1-28-16-21(27)25-11-5-10-24(12-13-25)19-9-8-17(14-22-19)23-20(26)15-29-18-6-3-2-4-7-18/h2-4,6-9,14H,5,10-13,15-16H2,1H3,(H,23,26)