ethyl 4-oxidanylidene-2-phenyl-3-[3-[4-(quinolin-2-ylmethyl)piperazin-1-yl]propoxy]chromene-6-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-2-phenyl-3-[3-[4-(quinolin-2-ylmethyl)piperazin-1-yl]propoxy]chromene-6-carboxylate Openeye Name: ethyl 4-oxo-2-phenyl-3-[3-[4-(2-quinolylmethyl)piperazin-1-yl]propoxy]chromene-6-carboxylate CAS Name: 4-oxo-2-phenyl-3-[3-[4-(2-quinolinylmethyl)-1-piperazinyl]propoxy]-1-benzopyran-6-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-2-phenyl-3-[3-[4-(quinolin-2-ylmethyl)piperazin-1-yl]propoxy]chromene-6-carboxylate Traditional Name: 4-keto-2-phenyl-3-[3-[4-(2-quinolylmethyl)piperazino]propoxy]chromene-6-carboxylic acid ethyl ester Formula: C35H35N3O5 MolecularWeight: 577.6695

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)OC(=C(C2=O)OCCCN3CCN(CC3)CC4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)OC(=C(C2=O)OCCCN3CCN(CC3)CC4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6

InChI

InChI=1S/C35H35N3O5/c1-2-41-35(40)27-14-16-31-29(23-27)32(39)34(33(43-31)26-10-4-3-5-11-26)42-22-8-17-37-18-20-38(21-19-37)24-28-15-13-25-9-6-7-12-30(25)36-28/h3-7,9-16,23H,2,8,17-22,24H2,1H3