3-[[5-(6-carbamimidoylnaphthalen-2-yl)oxycarbonylfuran-2-yl]methylamino]-2-methyl-3-oxidanylidene-propanoic acid hydrochloride

Systemtic Name: 3-[[5-(6-carbamimidoylnaphthalen-2-yl)oxycarbonylfuran-2-yl]methylamino]-2-methyl-3-oxidanylidene-propanoic acid hydrochloride Openeye Name: 3-[[5-[(6-carbamimidoyl-2-naphthyl)oxycarbonyl]-2-furyl]methylamino]-2-methyl-3-oxo-propanoic acid hydrochloride CAS Name: 3-[[5-[(6-carbamimidoyl-2-naphthalenyl)oxy-oxomethyl]-2-furanyl]methylamino]-2-methyl-3-oxopropanoic acid hydrochloride IUPAC Name: 3-[[5-(6-carbamimidoylnaphthalen-2-yl)oxycarbonylfuran-2-yl]methylamino]-2-methyl-3-oxopropanoic acid hydrochloride Traditional Name: 3-[[5-(6-amidino-2-naphthoxy)carbonyl-2-furyl]methylamino]-3-keto-2-methyl-propionic acid hydrochloride Formula: C21H20ClN3O6 MolecularWeight: 445.853

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(O1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)C(=O)O.Cl

Isomeric SMILES

CC(C(=O)NCC1=CC=C(O1)C(=O)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)C(=O)O.Cl

InChI

InChI=1S/C21H19N3O6.ClH/c1-11(20(26)27)19(25)24-10-16-6-7-17(29-16)21(28)30-15-5-4-12-8-14(18(22)23)3-2-13(12)9-15;/h2-9,11H,10H2,1H3,(H3,22,23)(H,24,25)(H,26,27);1H