ethyl 2-[[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]benzoate

Systemtic Name: ethyl 2-[[(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]amino]benzoate Openeye Name: ethyl 2-[[(2S)-2-amino-5-guanidino-pentanoyl]amino]benzoate CAS Name: 2-[[(2S)-2-amino-5-(diaminomethylideneamino)-1-oxopentyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]benzoate Traditional Name: 2-[[(2S)-2-amino-5-guanidino-pentanoyl]amino]benzoic acid ethyl ester Formula: C15H23N5O3 MolecularWeight: 321.37482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C(CCCN=C(N)N)N

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)[C@H](CCCN=C(N)N)N

InChI

InChI=1S/C15H23N5O3/c1-2-23-14(22)10-6-3-4-8-12(10)20-13(21)11(16)7-5-9-19-15(17)18/h3-4,6,8,11H,2,5,7,9,16H2,1H3,(H,20,21)(H4,17,18,19)/t11-/m0/s1