ethyl 4-[2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2-oxidanylidene-4-propyl-chromen-7-yl)oxyethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(2-oxo-4-propyl-chromen-7-yl)oxyacetyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-[(2-oxo-4-propyl-1-benzopyran-7-yl)oxy]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-oxo-4-propylchromen-7-yl)oxyacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-keto-4-propyl-chromen-7-yl)oxyacetyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C21H26N2O6/c1-3-5-15-12-20(25)29-18-13-16(6-7-17(15)18)28-14-19(24)22-8-10-23(11-9-22)21(26)27-4-2/h6-7,12-13H,3-5,8-11,14H2,1-2H3