2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 2-(6-methoxynaphthalen-2-yl)propanoic acid

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]pentanoic acid; 2-(6-methoxynaphthalen-2-yl)propanoic acid Openeye Name: 2-amino-5-guanidino-pentanoic acid; 2-(6-methoxy-2-naphthyl)propanoic acid CAS Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 2-(6-methoxy-2-naphthalenyl)propanoic acid IUPAC Name: 2-amino-5-(diaminomethylideneamino)pentanoic acid; 2-(6-methoxynaphthalen-2-yl)propanoic acid Traditional Name: 2-amino-5-guanidino-valeric acid; 2-(6-methoxy-2-naphthyl)propionic acid Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O.C(CC(C(=O)O)N)CN=C(N)N

InChI

InChI=1S/C14H14O3.C6H14N4O2/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10;7-4(5(11)12)2-1-3-10-6(8)9/h3-9H,1-2H3,(H,15,16);4H,1-3,7H2,(H,11,12)(H4,8,9,10)