5-[[(2S)-2-benzamido-5-[bis(azanyl)methylideneamino]pentanoyl]amino]pentanoic acid

Systemtic Name: 5-[[(2S)-2-benzamido-5-[bis(azanyl)methylideneamino]pentanoyl]amino]pentanoic acid Openeye Name: 5-[[(2S)-2-benzamido-5-guanidino-pentanoyl]amino]pentanoic acid CAS Name: 5-[[(2S)-2-benzamido-5-(diaminomethylideneamino)-1-oxopentyl]amino]pentanoic acid IUPAC Name: 5-[[(2S)-2-benzamido-5-(diaminomethylideneamino)pentanoyl]amino]pentanoic acid Traditional Name: 5-[[(2S)-2-benzamido-5-guanidino-pentanoyl]amino]valeric acid Formula: C18H27N5O4 MolecularWeight: 377.43808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)NCCCCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H27N5O4/c19-18(20)22-12-6-9-14(17(27)21-11-5-4-10-15(24)25)23-16(26)13-7-2-1-3-8-13/h1-3,7-8,14H,4-6,9-12H2,(H,21,27)(H,23,26)(H,24,25)(H4,19,20,22)/t14-/m0/s1