methyl (Z)-7-[2-[(4-chlorophenyl)sulfonylamino]-2,3-dihydro-1H-inden-5-yl]-7-pyridin-3-yl-hept-6-enoate

Systemtic Name: methyl (Z)-7-[2-[(4-chlorophenyl)sulfonylamino]-2,3-dihydro-1H-inden-5-yl]-7-pyridin-3-yl-hept-6-enoate Openeye Name: methyl (Z)-7-[2-[(4-chlorophenyl)sulfonylamino]indan-5-yl]-7-(3-pyridyl)hept-6-enoate CAS Name: (Z)-7-[2-[(4-chlorophenyl)sulfonylamino]-2,3-dihydro-1H-inden-5-yl]-7-(3-pyridinyl)-6-heptenoic acid methyl ester IUPAC Name: methyl (Z)-7-[2-[(4-chlorophenyl)sulfonylamino]-2,3-dihydro-1H-inden-5-yl]-7-pyridin-3-ylhept-6-enoate Traditional Name: (Z)-7-[2-[(4-chlorophenyl)sulfonylamino]indan-5-yl]-7-(3-pyridyl)hept-6-enoic acid methyl ester Formula: C28H29ClN2O4S MolecularWeight: 525.05886

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCC=C(C1=CC2=C(CC(C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C=C1)C4=CN=CC=C4

Isomeric SMILES

COC(=O)CCCC/C=C(/C1=CC2=C(CC(C2)NS(=O)(=O)C3=CC=C(C=C3)Cl)C=C1)\C4=CN=CC=C4

InChI

InChI=1S/C28H29ClN2O4S/c1-35-28(32)8-4-2-3-7-27(22-6-5-15-30-19-22)21-10-9-20-17-25(18-23(20)16-21)31-36(33,34)26-13-11-24(29)12-14-26/h5-7,9-16,19,25,31H,2-4,8,17-18H2,1H3/b27-7-