4-methyl-2-[[(2R)-4-methyl-2-[2-oxidanylidene-2-(9H-xanthen-9-yl)ethyl]pentanoyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[(2R)-4-methyl-2-[2-oxidanylidene-2-(9H-xanthen-9-yl)ethyl]pentanoyl]amino]pentanoic acid Openeye Name: 4-methyl-2-[[(2R)-4-methyl-2-[2-oxo-2-(9H-xanthen-9-yl)ethyl]pentanoyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[(2R)-4-methyl-1-oxo-2-[2-oxo-2-(9H-xanthen-9-yl)ethyl]pentyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[(2R)-4-methyl-2-[2-oxo-2-(9H-xanthen-9-yl)ethyl]pentanoyl]amino]pentanoic acid Traditional Name: 2-[[(2R)-2-[2-keto-2-(9H-xanthen-9-yl)ethyl]-4-methyl-pentanoyl]amino]-4-methyl-valeric acid Formula: C27H33NO5 MolecularWeight: 451.55462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC(C)C[C@H](CC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13)C(=O)NC(CC(C)C)C(=O)O

InChI

InChI=1S/C27H33NO5/c1-16(2)13-18(26(30)28-21(27(31)32)14-17(3)4)15-22(29)25-19-9-5-7-11-23(19)33-24-12-8-6-10-20(24)25/h5-12,16-18,21,25H,13-15H2,1-4H3,(H,28,30)(H,31,32)/t18-,21?/m1/s1