4-[[2-(6-carbamimidoylnaphthalen-1-yl)imidazolidin-2-yl]amino]benzoic acid

Systemtic Name: 4-[[2-(6-carbamimidoylnaphthalen-1-yl)imidazolidin-2-yl]amino]benzoic acid Openeye Name: 4-[[2-(6-carbamimidoyl-1-naphthyl)imidazolidin-2-yl]amino]benzoic acid CAS Name: 4-[[2-(6-carbamimidoyl-1-naphthalenyl)-2-imidazolidinyl]amino]benzoic acid IUPAC Name: 4-[[2-(6-carbamimidoylnaphthalen-1-yl)imidazolidin-2-yl]amino]benzoic acid Traditional Name: 4-[[2-(6-amidino-1-naphthyl)imidazolidin-2-yl]amino]benzoic acid Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(N1)(C2=CC=CC3=C2C=CC(=C3)C(=N)N)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CNC(N1)(C2=CC=CC3=C2C=CC(=C3)C(=N)N)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C21H21N5O2/c22-19(23)15-6-9-17-14(12-15)2-1-3-18(17)21(24-10-11-25-21)26-16-7-4-13(5-8-16)20(27)28/h1-9,12,24-26H,10-11H2,(H3,22,23)(H,27,28)