(2S)-2-azanyl-N-(2-azanylethyl)-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanamide

Systemtic Name: (2S)-2-azanyl-N-(2-azanylethyl)-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanamide Openeye Name: (2S)-2-amino-N-(2-aminoethyl)-3-(4-hydroxy-2,6-dimethyl-phenyl)propanamide CAS Name: (2S)-2-amino-N-(2-aminoethyl)-3-(4-hydroxy-2,6-dimethylphenyl)propanamide IUPAC Name: (2S)-2-amino-N-(2-aminoethyl)-3-(4-hydroxy-2,6-dimethylphenyl)propanamide Traditional Name: (2S)-2-amino-N-(2-aminoethyl)-3-(4-hydroxy-2,6-dimethyl-phenyl)propionamide Formula: C13H21N3O2 MolecularWeight: 251.32474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC(C(=O)NCCN)N)C)O

Isomeric SMILES

CC1=CC(=CC(=C1C[C@@H](C(=O)NCCN)N)C)O

InChI

InChI=1S/C13H21N3O2/c1-8-5-10(17)6-9(2)11(8)7-12(15)13(18)16-4-3-14/h5-6,12,17H,3-4,7,14-15H2,1-2H3,(H,16,18)/t12-/m0/s1