[1-(2-azanyl-2-oxidanylidene-ethyl)-6-carbamimidoyl-naphthalen-2-yl] 4-[(2,2-dimethylhydrazinyl)methylideneamino]benzoate

Systemtic Name: [1-(2-azanyl-2-oxidanylidene-ethyl)-6-carbamimidoyl-naphthalen-2-yl] 4-[(2,2-dimethylhydrazinyl)methylideneamino]benzoate Openeye Name: [1-(2-amino-2-oxo-ethyl)-6-carbamimidoyl-2-naphthyl] 4-[(2,2-dimethylhydrazino)methyleneamino]benzoate CAS Name: 4-[(2,2-dimethylhydrazinyl)methylideneamino]benzoic acid [1-(2-amino-2-oxoethyl)-6-carbamimidoyl-2-naphthalenyl] ester IUPAC Name: [1-(2-amino-2-oxoethyl)-6-carbamimidoylnaphthalen-2-yl] 4-[(2,2-dimethylhydrazinyl)methylideneamino]benzoate Traditional Name: 4-[(N',N'-dimethylhydrazino)methyleneamino]benzoic acid [6-amidino-1-(2-amino-2-keto-ethyl)-2-naphthyl] ester Formula: C23H24N6O3 MolecularWeight: 432.47506

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)NC=NC1=CC=C(C=C1)C(=O)OC2=C(C3=C(C=C2)C=C(C=C3)C(=N)N)CC(=O)N

Isomeric SMILES

CN(C)NC=NC1=CC=C(C=C1)C(=O)OC2=C(C3=C(C=C2)C=C(C=C3)C(=N)N)CC(=O)N

InChI

InChI=1S/C23H24N6O3/c1-29(2)28-13-27-17-7-3-14(4-8-17)23(31)32-20-10-6-15-11-16(22(25)26)5-9-18(15)19(20)12-21(24)30/h3-11,13H,12H2,1-2H3,(H2,24,30)(H3,25,26)(H,27,28)