2-[[2-(azepan-1-yl)phenyl]amino]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)ethanamide

Systemtic Name: 2-[[2-(azepan-1-yl)phenyl]amino]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)ethanamide Openeye Name: 2-[2-(azepan-1-yl)anilino]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide CAS Name: 2-[2-(1-azepanyl)anilino]-N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-oxomethyl]acetamide IUPAC Name: 2-[2-(azepan-1-yl)anilino]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide Traditional Name: 2-[2-(azepan-1-yl)anilino]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)acetamide Formula: C23H28N4O4 MolecularWeight: 424.49282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NCC(=O)NC(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NCC(=O)NC(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C23H28N4O4/c28-22(26-23(29)25-17-9-10-20-21(15-17)31-14-13-30-20)16-24-18-7-3-4-8-19(18)27-11-5-1-2-6-12-27/h3-4,7-10,15,24H,1-2,5-6,11-14,16H2,(H2,25,26,28,29)