(3R)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3,4-dihydro-2H-chromene-3-carboxamide

Systemtic Name: (3R)-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)-3,4-dihydro-2H-chromene-3-carboxamide Openeye Name: (3R)-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]chromane-3-carboxamide CAS Name: (3R)-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide IUPAC Name: (3R)-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-3,4-dihydro-2H-chromene-3-carboxamide Traditional Name: (3R)-N-(2-methoxy-5-piperidinosulfonyl-phenyl)chroman-3-carboxamide Formula: C22H26N2O5S MolecularWeight: 430.51724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CC4=CC=CC=C4OC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)[C@@H]3CC4=CC=CC=C4OC3

InChI

InChI=1S/C22H26N2O5S/c1-28-21-10-9-18(30(26,27)24-11-5-2-6-12-24)14-19(21)23-22(25)17-13-16-7-3-4-8-20(16)29-15-17/h3-4,7-10,14,17H,2,5-6,11-13,15H2,1H3,(H,23,25)/t17-/m1/s1