[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl] 2-naphthalen-1-ylethanoate

Systemtic Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxidanylidene-ethyl] 2-naphthalen-1-ylethanoate Openeye Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxo-ethyl] 2-(1-naphthyl)acetate CAS Name: 2-(1-naphthalenyl)acetic acid [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-oxoethyl] 2-naphthalen-1-ylacetate Traditional Name: 2-(1-naphthyl)acetic acid [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-2-keto-ethyl] ester Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)COC(=O)CC3=CC=CC4=CC=CC=C43)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)COC(=O)CC3=CC=CC4=CC=CC=C43)OC1

InChI

InChI=1S/C23H21NO5/c25-22(24-18-9-10-20-21(14-18)28-12-4-11-27-20)15-29-23(26)13-17-7-3-6-16-5-1-2-8-19(16)17/h1-3,5-10,14H,4,11-13,15H2,(H,24,25)