(2R)-6-azanyl-2-[2-(1H-indol-3-yl)ethyl-(2-oxidanylidenechromen-3-yl)carbonyl-amino]hexanoic acid

Systemtic Name: (2R)-6-azanyl-2-[2-(1H-indol-3-yl)ethyl-(2-oxidanylidenechromen-3-yl)carbonyl-amino]hexanoic acid Openeye Name: (2R)-6-amino-2-[2-(1H-indol-3-yl)ethyl-(2-oxochromene-3-carbonyl)amino]hexanoic acid CAS Name: (2R)-6-amino-2-[2-(1H-indol-3-yl)ethyl-[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]hexanoic acid IUPAC Name: (2R)-6-amino-2-[2-(1H-indol-3-yl)ethyl-(2-oxochromene-3-carbonyl)amino]hexanoic acid Traditional Name: (2R)-6-amino-2-[2-(1H-indol-3-yl)ethyl-(2-ketochromene-3-carbonyl)amino]hexanoic acid Formula: C26H27N3O5 MolecularWeight: 461.50968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)N(CCC3=CNC4=CC=CC=C43)C(CCCCN)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)O2)C(=O)N(CCC3=CNC4=CC=CC=C43)[C@H](CCCCN)C(=O)O

InChI

InChI=1S/C26H27N3O5/c27-13-6-5-10-22(25(31)32)29(14-12-18-16-28-21-9-3-2-8-19(18)21)24(30)20-15-17-7-1-4-11-23(17)34-26(20)33/h1-4,7-9,11,15-16,22,28H,5-6,10,12-14,27H2,(H,31,32)/t22-/m1/s1