1-(5-chloranyl-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(5-chloro-2-methoxyphenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-keto-pyrrolidine-3-carboxamide Formula: C21H21ClN2O5 MolecularWeight: 416.85484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H21ClN2O5/c1-27-17-5-3-14(22)10-16(17)24-12-13(9-20(24)25)21(26)23-15-4-6-18-19(11-15)29-8-2-7-28-18/h3-6,10-11,13H,2,7-9,12H2,1H3,(H,23,26)