(6-carbamimidoylnaphthalen-2-yl) 5-[1-[4-[bis(azanyl)methylideneamino]phenyl]ethyl]furan-2-carboxylate

Systemtic Name: (6-carbamimidoylnaphthalen-2-yl) 5-[1-[4-[bis(azanyl)methylideneamino]phenyl]ethyl]furan-2-carboxylate Openeye Name: (6-carbamimidoyl-2-naphthyl) 5-[1-(4-guanidinophenyl)ethyl]furan-2-carboxylate CAS Name: 5-[1-[4-(diaminomethylideneamino)phenyl]ethyl]-2-furancarboxylic acid (6-carbamimidoyl-2-naphthalenyl) ester IUPAC Name: (6-carbamimidoylnaphthalen-2-yl) 5-[1-[4-(diaminomethylideneamino)phenyl]ethyl]furan-2-carboxylate Traditional Name: 5-[1-(4-guanidinophenyl)ethyl]furan-2-carboxylic acid (6-amidino-2-naphthyl) ester Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N=C(N)N)C2=CC=C(O2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)C(=N)N

Isomeric SMILES

CC(C1=CC=C(C=C1)N=C(N)N)C2=CC=C(O2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)C(=N)N

InChI

InChI=1S/C25H23N5O3/c1-14(15-4-7-19(8-5-15)30-25(28)29)21-10-11-22(33-21)24(31)32-20-9-6-16-12-18(23(26)27)3-2-17(16)13-20/h2-14H,1H3,(H3,26,27)(H4,28,29,30)