(2S)-3-[[3-(5-carbazol-9-ylpentyl)-1,2-oxazol-5-yl]methoxy]-2-(hexanoylamino)propanoic acid

Systemtic Name: (2S)-3-[[3-(5-carbazol-9-ylpentyl)-1,2-oxazol-5-yl]methoxy]-2-(hexanoylamino)propanoic acid Openeye Name: (2S)-3-[[3-(5-carbazol-9-ylpentyl)isoxazol-5-yl]methoxy]-2-(hexanoylamino)propanoic acid CAS Name: (2S)-3-[[3-[5-(9-carbazolyl)pentyl]-5-isoxazolyl]methoxy]-2-(1-oxohexylamino)propanoic acid IUPAC Name: (2S)-3-[[3-(5-carbazol-9-ylpentyl)-1,2-oxazol-5-yl]methoxy]-2-(hexanoylamino)propanoic acid Traditional Name: (2S)-2-(caproylamino)-3-[[3-(5-carbazol-9-ylpentyl)isoxazol-5-yl]methoxy]propionic acid Formula: C30H37N3O5 MolecularWeight: 519.63188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(COCC1=CC(=NO1)CCCCCN2C3=CC=CC=C3C4=CC=CC=C42)C(=O)O

Isomeric SMILES

CCCCCC(=O)N[C@@H](COCC1=CC(=NO1)CCCCCN2C3=CC=CC=C3C4=CC=CC=C42)C(=O)O

InChI

InChI=1S/C30H37N3O5/c1-2-3-5-17-29(34)31-26(30(35)36)21-37-20-23-19-22(32-38-23)12-6-4-11-18-33-27-15-9-7-13-24(27)25-14-8-10-16-28(25)33/h7-10,13-16,19,26H,2-6,11-12,17-18,20-21H2,1H3,(H,31,34)(H,35,36)/t26-/m0/s1