(6-carbamimidoylnaphthalen-2-yl) 6-[bis(azanyl)methylideneamino]hexanoate

Systemtic Name: (6-carbamimidoylnaphthalen-2-yl) 6-[bis(azanyl)methylideneamino]hexanoate Openeye Name: (6-carbamimidoyl-2-naphthyl) 6-guanidinohexanoate CAS Name: 6-(diaminomethylideneamino)hexanoic acid (6-carbamimidoyl-2-naphthalenyl) ester IUPAC Name: (6-carbamimidoylnaphthalen-2-yl) 6-(diaminomethylideneamino)hexanoate Traditional Name: 6-guanidinohexanoic acid (6-amidino-2-naphthyl) ester Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)OC(=O)CCCCCN=C(N)N)C=C1C(=N)N

Isomeric SMILES

C1=CC2=C(C=CC(=C2)OC(=O)CCCCCN=C(N)N)C=C1C(=N)N

InChI

InChI=1S/C18H23N5O2/c19-17(20)14-6-5-13-11-15(8-7-12(13)10-14)25-16(24)4-2-1-3-9-23-18(21)22/h5-8,10-11H,1-4,9H2,(H3,19,20)(H4,21,22,23)