copper (2S)-2-[(4-carbamimidoyl-2-oxidanidyl-phenyl)methylideneamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: copper (2S)-2-[(4-carbamimidoyl-2-oxidanidyl-phenyl)methylideneamino]-3-(1H-indol-3-yl)propanoate Openeye Name: copper (2S)-2-[(4-carbamimidoyl-2-oxido-phenyl)methyleneamino]-3-(1H-indol-3-yl)propanoate CAS Name: copper (2S)-2-[(4-carbamimidoyl-2-oxidophenyl)methylideneamino]-3-(1H-indol-3-yl)propanoate IUPAC Name: copper (2S)-2-[(4-carbamimidoyl-2-oxidophenyl)methylideneamino]-3-(1H-indol-3-yl)propanoate Traditional Name: cupric (2S)-2-[(4-amidino-2-oxido-benzylidene)amino]-3-(1H-indol-3-yl)propionate Formula: C19H16CuN4O3 MolecularWeight: 411.90134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])N=CC3=C(C=C(C=C3)C(=N)N)[O-].[Cu+2]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)[O-])N=CC3=C(C=C(C=C3)C(=N)N)[O-].[Cu+2]

InChI

InChI=1S/C19H18N4O3.Cu/c20-18(21)11-5-6-12(17(24)8-11)9-23-16(19(25)26)7-13-10-22-15-4-2-1-3-14(13)15;/h1-6,8-10,16,22,24H,7H2,(H3,20,21)(H,25,26);/q;+2/p-2/t16-;/m0./s1