[4-[[4-[(7-chloranyl-2H-chromen-3-yl)sulfonyl]-2-oxidanylidene-piperazin-1-yl]methyl]-1-pyridin-4-yl-piperidin-4-yl] ethanoate

Systemtic Name: [4-[[4-[(7-chloranyl-2H-chromen-3-yl)sulfonyl]-2-oxidanylidene-piperazin-1-yl]methyl]-1-pyridin-4-yl-piperidin-4-yl] ethanoate Openeye Name: [4-[[4-[(7-chloro-2H-chromen-3-yl)sulfonyl]-2-oxo-piperazin-1-yl]methyl]-1-(4-pyridyl)-4-piperidyl] acetate CAS Name: acetic acid [4-[[4-[(7-chloro-2H-1-benzopyran-3-yl)sulfonyl]-2-oxo-1-piperazinyl]methyl]-1-pyridin-4-yl-4-piperidinyl] ester IUPAC Name: [4-[[4-[(7-chloro-2H-chromen-3-yl)sulfonyl]-2-oxopiperazin-1-yl]methyl]-1-pyridin-4-ylpiperidin-4-yl] acetate Traditional Name: acetic acid [4-[[4-[(7-chloro-2H-chromen-3-yl)sulfonyl]-2-keto-piperazino]methyl]-1-(4-pyridyl)-4-piperidyl] ester Formula: C26H29ClN4O6S MolecularWeight: 561.04966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCN(CC1)C2=CC=NC=C2)CN3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C(C=C5)Cl)OC4

Isomeric SMILES

CC(=O)OC1(CCN(CC1)C2=CC=NC=C2)CN3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C(C=C5)Cl)OC4

InChI

InChI=1S/C26H29ClN4O6S/c1-19(32)37-26(6-10-29(11-7-26)22-4-8-28-9-5-22)18-30-12-13-31(16-25(30)33)38(34,35)23-14-20-2-3-21(27)15-24(20)36-17-23/h2-5,8-9,14-15H,6-7,10-13,16-18H2,1H3