2-ethyl-4-[3-[1-methoxy-8-(methylsulfonylamino)-6H-benzo[c]chromen-6-yl]phenyl]butanoate

Systemtic Name: 2-ethyl-4-[3-[1-methoxy-8-(methylsulfonylamino)-6H-benzo[c]chromen-6-yl]phenyl]butanoate Openeye Name: 2-ethyl-4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c]chromen-6-yl]phenyl]butanoate CAS Name: 2-ethyl-4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c][1]benzopyran-6-yl]phenyl]butanoate IUPAC Name: 2-ethyl-4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c]chromen-6-yl]phenyl]butanoate Traditional Name: 2-ethyl-4-[3-[8-(methanesulfonamido)-1-methoxy-6H-benzo[c]chromen-6-yl]phenyl]butyrate Formula: C27H28NO6S- MolecularWeight: 494.57932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=CC(=C1)C2C3=C(C=CC(=C3)NS(=O)(=O)C)C4=C(O2)C=CC=C4OC)C(=O)[O-]

Isomeric SMILES

CCC(CCC1=CC=CC(=C1)C2C3=C(C=CC(=C3)NS(=O)(=O)C)C4=C(O2)C=CC=C4OC)C(=O)[O-]

InChI

InChI=1S/C27H29NO6S/c1-4-18(27(29)30)12-11-17-7-5-8-19(15-17)26-22-16-20(28-35(3,31)32)13-14-21(22)25-23(33-2)9-6-10-24(25)34-26/h5-10,13-16,18,26,28H,4,11-12H2,1-3H3,(H,29,30)/p-1