5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-5-keto-3,3-dimethyl-valerate Formula: C16H20NO5- MolecularWeight: 306.3337

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=CC2=C(C=C1)OCCCO2)CC(=O)[O-]

Isomeric SMILES

CC(C)(CC(=O)NC1=CC2=C(C=C1)OCCCO2)CC(=O)[O-]

InChI

InChI=1S/C16H21NO5/c1-16(2,10-15(19)20)9-14(18)17-11-4-5-12-13(8-11)22-7-3-6-21-12/h4-5,8H,3,6-7,9-10H2,1-2H3,(H,17,18)(H,19,20)/p-1