methyl 2-benzamido-5-[bis(azanyl)methylideneamino]pentanoate hydrochloride

Systemtic Name: methyl 2-benzamido-5-[bis(azanyl)methylideneamino]pentanoate hydrochloride Openeye Name: methyl 2-benzamido-5-guanidino-pentanoate hydrochloride CAS Name: 2-benzamido-5-(diaminomethylideneamino)pentanoic acid methyl ester hydrochloride IUPAC Name: methyl 2-benzamido-5-(diaminomethylideneamino)pentanoate hydrochloride Traditional Name: 2-benzamido-5-guanidino-valeric acid methyl ester hydrochloride Formula: C14H21ClN4O3 MolecularWeight: 328.79454

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCN=C(N)N)NC(=O)C1=CC=CC=C1.Cl

Isomeric SMILES

COC(=O)C(CCCN=C(N)N)NC(=O)C1=CC=CC=C1.Cl

InChI

InChI=1S/C14H20N4O3.ClH/c1-21-13(20)11(8-5-9-17-14(15)16)18-12(19)10-6-3-2-4-7-10;/h2-4,6-7,11H,5,8-9H2,1H3,(H,18,19)(H4,15,16,17);1H