methyl 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)benzoate

Systemtic Name: methyl 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)benzoate Openeye Name: methyl 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)benzoate CAS Name: 4-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)benzoate Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)benzoic acid methyl ester Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H17NO5/c1-22-18(21)13-5-3-12(4-6-13)17(20)19-14-7-8-15-16(11-14)24-10-2-9-23-15/h3-8,11H,2,9-10H2,1H3,(H,19,20)