(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-thiophen-3-yl-propanoate

Systemtic Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-thiophen-3-yl-propanoate Openeye Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-thienyl)propanoate CAS Name: (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-3-(3-thiophenyl)propanoate IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-thiophen-3-ylpropanoate Traditional Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-thienyl)propionate Formula: C22H18NO4S- MolecularWeight: 392.44762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CSC=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CSC=C4)C(=O)[O-]

InChI

InChI=1S/C22H19NO4S/c24-21(25)20(11-14-9-10-28-13-14)23-22(26)27-12-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-10,13,19-20H,11-12H2,(H,23,26)(H,24,25)/p-1/t20-/m0/s1