5-[bis(azanyl)methylideneamino]-2-[2-(naphthalen-1-ylamino)ethanoylamino]pentanoic acid

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[2-(naphthalen-1-ylamino)ethanoylamino]pentanoic acid Openeye Name: 5-guanidino-2-[[2-(1-naphthylamino)acetyl]amino]pentanoic acid CAS Name: 5-(diaminomethylideneamino)-2-[[2-(1-naphthalenylamino)-1-oxoethyl]amino]pentanoic acid IUPAC Name: 5-(diaminomethylideneamino)-2-[[2-(naphthalen-1-ylamino)acetyl]amino]pentanoic acid Traditional Name: 5-guanidino-2-[[2-(1-naphthylamino)acetyl]amino]valeric acid Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NCC(=O)NC(CCCN=C(N)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NCC(=O)NC(CCCN=C(N)N)C(=O)O

InChI

InChI=1S/C18H23N5O3/c19-18(20)21-10-4-9-15(17(25)26)23-16(24)11-22-14-8-3-6-12-5-1-2-7-13(12)14/h1-3,5-8,15,22H,4,9-11H2,(H,23,24)(H,25,26)(H4,19,20,21)