ethyl 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propoxy]-4-methyl-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: ethyl 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propoxy]-4-methyl-2-oxidanylidene-chromene-3-carboxylate Openeye Name: ethyl 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propoxy]-4-methyl-2-oxo-chromene-3-carboxylate CAS Name: 7-[3-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]propoxy]-4-methyl-2-oxo-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]propoxy]-4-methyl-2-oxochromene-3-carboxylate Traditional Name: 7-[3-[4-(4-chlorobenzyl)piperazino]propoxy]-2-keto-4-methyl-chromene-3-carboxylic acid ethyl ester Formula: C27H31ClN2O5 MolecularWeight: 498.99844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C(C=C2)OCCCN3CCN(CC3)CC4=CC=C(C=C4)Cl)OC1=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C(C=C2)OCCCN3CCN(CC3)CC4=CC=C(C=C4)Cl)OC1=O)C

InChI

InChI=1S/C27H31ClN2O5/c1-3-33-26(31)25-19(2)23-10-9-22(17-24(23)35-27(25)32)34-16-4-11-29-12-14-30(15-13-29)18-20-5-7-21(28)8-6-20/h5-10,17H,3-4,11-16,18H2,1-2H3