bis(azanyl)methylidene-[(2R)-3-[(2,4-dimethylphenyl)-ethanoyl-amino]-2-oxidanyl-propyl]azanium

Systemtic Name: bis(azanyl)methylidene-[(2R)-3-[(2,4-dimethylphenyl)-ethanoyl-amino]-2-oxidanyl-propyl]azanium Openeye Name: [(2R)-3-(N-acetyl-2,4-dimethyl-anilino)-2-hydroxy-propyl]-(diaminomethylene)ammonium CAS Name: [(2R)-3-(N-acetyl-2,4-dimethylanilino)-2-hydroxypropyl]-(diaminomethylidene)ammonium IUPAC Name: [(2R)-3-(N-acetyl-2,4-dimethylanilino)-2-hydroxypropyl]-(diaminomethylidene)azanium Traditional Name: [(2R)-3-(N-acetyl-2,4-dimethyl-anilino)-2-hydroxy-propyl]-(diaminomethylene)ammonium Formula: C14H23N4O2+ MolecularWeight: 279.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(CC(C[NH+]=C(N)N)O)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(C[C@H](C[NH+]=C(N)N)O)C(=O)C)C

InChI

InChI=1S/C14H22N4O2/c1-9-4-5-13(10(2)6-9)18(11(3)19)8-12(20)7-17-14(15)16/h4-6,12,20H,7-8H2,1-3H3,(H4,15,16,17)/p+1/t12-/m0/s1