N-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-prop-2-ynyl-carbamate

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-prop-2-ynyl-carbamate Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-prop-2-ynyl-carbamate CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-prop-2-ynylcarbamate IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-prop-2-ynylcarbamate Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-yl)-N-propargyl-carbamate Formula: C13H12NO4- MolecularWeight: 246.23868

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1=C2C(=CC=C1)OCCCO2)C(=O)[O-]

Isomeric SMILES

C#CCN(C1=C2C(=CC=C1)OCCCO2)C(=O)[O-]

InChI

InChI=1S/C13H13NO4/c1-2-7-14(13(15)16)10-5-3-6-11-12(10)18-9-4-8-17-11/h1,3,5-6H,4,7-9H2,(H,15,16)/p-1