(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]-N-butyl-pentanamide; ethanoic acid

Systemtic Name: (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]-N-butyl-pentanamide; ethanoic acid Openeye Name: acetic acid; (2S)-2-amino-N-butyl-5-guanidino-pentanamide CAS Name: acetic acid; (2S)-2-amino-N-butyl-5-(diaminomethylideneamino)pentanamide IUPAC Name: acetic acid; (2S)-2-amino-N-butyl-5-(diaminomethylideneamino)pentanamide Traditional Name: acetic acid; (2S)-2-amino-N-butyl-5-guanidino-valeramide Formula: C12H27N5O3 MolecularWeight: 289.37448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CCCN=C(N)N)N.CC(=O)O

Isomeric SMILES

CCCCNC(=O)[C@H](CCCN=C(N)N)N.CC(=O)O

InChI

InChI=1S/C10H23N5O.C2H4O2/c1-2-3-6-14-9(16)8(11)5-4-7-15-10(12)13;1-2(3)4/h8H,2-7,11H2,1H3,(H,14,16)(H4,12,13,15);1H3,(H,3,4)/t8-;/m0./s1