3-azanyl-5-[3-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethyl]-5-(2,2-dimethylhydrazinyl)-4-oxidanylidene-pyran-2-yl]benzoic acid

Systemtic Name: 3-azanyl-5-[3-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxidanylidene-ethyl]-5-(2,2-dimethylhydrazinyl)-4-oxidanylidene-pyran-2-yl]benzoic acid Openeye Name: 3-amino-5-[3-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxo-ethyl]-5-(2,2-dimethylhydrazino)-4-oxo-pyran-2-yl]benzoic acid CAS Name: 3-amino-5-[3-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]-5-(2,2-dimethylhydrazinyl)-4-oxo-2-pyranyl]benzoic acid IUPAC Name: 3-amino-5-[3-[2-[(4-carbamimidoylphenyl)methylamino]-2-oxoethyl]-5-(2,2-dimethylhydrazinyl)-4-oxopyran-2-yl]benzoic acid Traditional Name: 3-[3-[2-[(4-amidinobenzyl)amino]-2-keto-ethyl]-5-(N',N'-dimethylhydrazino)-4-keto-pyran-2-yl]-5-amino-benzoic acid Formula: C24H26N6O5 MolecularWeight: 478.50044

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)NC1=COC(=C(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)N)C3=CC(=CC(=C3)N)C(=O)O

Isomeric SMILES

CN(C)NC1=COC(=C(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)N)C3=CC(=CC(=C3)N)C(=O)O

InChI

InChI=1S/C24H26N6O5/c1-30(2)29-19-12-35-22(15-7-16(24(33)34)9-17(25)8-15)18(21(19)32)10-20(31)28-11-13-3-5-14(6-4-13)23(26)27/h3-9,12,29H,10-11,25H2,1-2H3,(H3,26,27)(H,28,31)(H,33,34)