methyl 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Openeye Name: methyl 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-oxomethyl]-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-ethyl-4-methyl-1H-pyrrole-3-carboxylic acid methyl ester Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=CC3=C(C=C2)OCCCO3)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=CC3=C(C=C2)OCCCO3)C)C(=O)OC

InChI

InChI=1S/C19H22N2O5/c1-4-13-16(19(23)24-3)11(2)17(21-13)18(22)20-12-6-7-14-15(10-12)26-9-5-8-25-14/h6-7,10,21H,4-5,8-9H2,1-3H3,(H,20,22)