(2S)-2,5-bis(azanyl)-5-oxidanylidene-pentanoate; phenethylbenzene; hydrochloride

Systemtic Name: (2S)-2,5-bis(azanyl)-5-oxidanylidene-pentanoate; phenethylbenzene; hydrochloride Openeye Name: (2S)-2,5-diamino-5-oxo-pentanoate; phenethylbenzene; hydrochloride CAS Name: (2S)-2,5-diamino-5-oxopentanoate; phenethylbenzene; hydrochloride IUPAC Name: (2S)-2,5-diamino-5-oxopentanoate; phenethylbenzene; hydrochloride Traditional Name: (2S)-2,5-diamino-5-keto-valerate; phenethylbenzene; hydrochloride Formula: C19H24ClN2O3- MolecularWeight: 363.85846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=CC=C2.C(CC(=O)N)C(C(=O)[O-])N.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=CC=C2.C(CC(=O)N)[C@@H](C(=O)[O-])N.Cl

InChI

InChI=1S/C14H14.C5H10N2O3.ClH/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14;6-3(5(9)10)1-2-4(7)8;/h1-10H,11-12H2;3H,1-2,6H2,(H2,7,8)(H,9,10);1H/p-1/t;3-;/m.0./s1