4-azanyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butanamide

Systemtic Name: 4-azanyl-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butanamide Openeye Name: 4-amino-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butanamide CAS Name: 4-amino-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butanamide IUPAC Name: 4-amino-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butanamide Traditional Name: 4-amino-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)butyramide Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCCN)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCCN)OC1

InChI

InChI=1S/C13H18N2O3/c14-6-1-3-13(16)15-10-4-5-11-12(9-10)18-8-2-7-17-11/h4-5,9H,1-3,6-8,14H2,(H,15,16)