3-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide; ethanedioic acid

Systemtic Name: 3-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide; ethanedioic acid Openeye Name: 3-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide; oxalic acid CAS Name: 3-(1-azepanyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide; oxalic acid IUPAC Name: 3-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide; oxalic acid Traditional Name: 3-(azepan-1-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propionamide; oxalic acid Formula: C19H26N2O7 MolecularWeight: 394.41894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCC(=O)NC2=CC3=C(C=C2)OCCO3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCCN(CC1)CCC(=O)NC2=CC3=C(C=C2)OCCO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H24N2O3.C2H2O4/c20-17(7-10-19-8-3-1-2-4-9-19)18-14-5-6-15-16(13-14)22-12-11-21-15;3-1(4)2(5)6/h5-6,13H,1-4,7-12H2,(H,18,20);(H,3,4)(H,5,6)