3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propionamide Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NCCC(=O)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NCCC(=O)N)OC1

InChI

InChI=1S/C12H16N2O3/c13-12(15)4-5-14-9-2-3-10-11(8-9)17-7-1-6-16-10/h2-3,8,14H,1,4-7H2,(H2,13,15)