methyl 8-[4-[4-[(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]butanoylamino]-6-methoxy-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: methyl 8-[4-[4-[(4-chlorophenyl)-pyridin-2-yl-methoxy]piperidin-1-yl]butanoylamino]-6-methoxy-4-oxidanylidene-chromene-2-carboxylate Openeye Name: methyl 8-[4-[4-[(4-chlorophenyl)-(2-pyridyl)methoxy]-1-piperidyl]butanoylamino]-6-methoxy-4-oxo-chromene-2-carboxylate CAS Name: 8-[[4-[4-[(4-chlorophenyl)-(2-pyridinyl)methoxy]-1-piperidinyl]-1-oxobutyl]amino]-6-methoxy-4-oxo-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 8-[4-[4-[(4-chlorophenyl)-pyridin-2-ylmethoxy]piperidin-1-yl]butanoylamino]-6-methoxy-4-oxochromene-2-carboxylate Traditional Name: 8-[4-[4-[(4-chlorophenyl)-(2-pyridyl)methoxy]piperidino]butanoylamino]-4-keto-6-methoxy-chromene-2-carboxylic acid methyl ester Formula: C33H34ClN3O7 MolecularWeight: 620.09196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C(=O)C=C(O2)C(=O)OC)NC(=O)CCCN3CCC(CC3)OC(C4=CC=C(C=C4)Cl)C5=CC=CC=N5

Isomeric SMILES

COC1=CC(=C2C(=C1)C(=O)C=C(O2)C(=O)OC)NC(=O)CCCN3CCC(CC3)OC(C4=CC=C(C=C4)Cl)C5=CC=CC=N5

InChI

InChI=1S/C33H34ClN3O7/c1-41-24-18-25-28(38)20-29(33(40)42-2)44-32(25)27(19-24)36-30(39)7-5-15-37-16-12-23(13-17-37)43-31(26-6-3-4-14-35-26)21-8-10-22(34)11-9-21/h3-4,6,8-11,14,18-20,23,31H,5,7,12-13,15-17H2,1-2H3,(H,36,39)