(3R,4R)-3-azaniumyl-5-(9H-fluoren-9-ylmethoxy)-5-oxidanylidene-4-thiophen-2-yl-pentanoate

Systemtic Name: (3R,4R)-3-azaniumyl-5-(9H-fluoren-9-ylmethoxy)-5-oxidanylidene-4-thiophen-2-yl-pentanoate Openeye Name: (3R,4R)-3-azaniumyl-5-(9H-fluoren-9-ylmethoxy)-5-oxo-4-(2-thienyl)pentanoate CAS Name: (3R,4R)-3-ammonio-5-(9H-fluoren-9-ylmethoxy)-5-oxo-4-thiophen-2-ylpentanoate IUPAC Name: (3R,4R)-3-azaniumyl-5-(9H-fluoren-9-ylmethoxy)-5-oxo-4-thiophen-2-ylpentanoate Traditional Name: (3R,4R)-3-ammonio-5-(9H-fluoren-9-ylmethoxy)-5-keto-4-(2-thienyl)valerate Formula: C23H21NO4S MolecularWeight: 407.48214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)C(C4=CC=CS4)C(CC(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)[C@H](C4=CC=CS4)[C@@H](CC(=O)[O-])[NH3+]

InChI

InChI=1S/C23H21NO4S/c24-19(12-21(25)26)22(20-10-5-11-29-20)23(27)28-13-18-16-8-3-1-6-14(16)15-7-2-4-9-17(15)18/h1-11,18-19,22H,12-13,24H2,(H,25,26)/t19-,22+/m1/s1