(2S)-2-(2,2-dimethyl-4-oxidanylidene-3-propyl-1,3-diazetidin-1-yl)-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-(2,2-dimethyl-4-oxidanylidene-3-propyl-1,3-diazetidin-1-yl)-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: (2S)-2-(2,2-dimethyl-4-oxo-3-propyl-1,3-diazetidin-1-yl)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: (2S)-2-(2,2-dimethyl-4-oxo-3-propyl-1,3-diazetidin-1-yl)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-(2,2-dimethyl-4-oxo-3-propyl-1,3-diazetidin-1-yl)-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: (2S)-3-(5-hydroxy-1H-indol-3-yl)-2-(4-keto-2,2-dimethyl-3-propyl-1,3-diazetidin-1-yl)propionic acid Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)N(C1(C)C)C(CC2=CNC3=C2C=C(C=C3)O)C(=O)O

Isomeric SMILES

CCCN1C(=O)N(C1(C)C)[C@@H](CC2=CNC3=C2C=C(C=C3)O)C(=O)O

InChI

InChI=1S/C18H23N3O4/c1-4-7-20-17(25)21(18(20,2)3)15(16(23)24)8-11-10-19-14-6-5-12(22)9-13(11)14/h5-6,9-10,15,19,22H,4,7-8H2,1-3H3,(H,23,24)/t15-/m0/s1