(6-carbamimidoylnaphthalen-2-yl) 4-[(5-methyl-4,5-dihydro-1H-imidazol-2-yl)amino]benzoate

Systemtic Name: (6-carbamimidoylnaphthalen-2-yl) 4-[(5-methyl-4,5-dihydro-1H-imidazol-2-yl)amino]benzoate Openeye Name: (6-carbamimidoyl-2-naphthyl) 4-[(5-methyl-4,5-dihydro-1H-imidazol-2-yl)amino]benzoate CAS Name: 4-[(5-methyl-4,5-dihydro-1H-imidazol-2-yl)amino]benzoic acid (6-carbamimidoyl-2-naphthalenyl) ester IUPAC Name: (6-carbamimidoylnaphthalen-2-yl) 4-[(5-methyl-4,5-dihydro-1H-imidazol-2-yl)amino]benzoate Traditional Name: 4-[(4-methyl-2-imidazolin-2-yl)amino]benzoic acid (6-amidino-2-naphthyl) ester Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN=C(N1)NC2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)C(=N)N

Isomeric SMILES

CC1CN=C(N1)NC2=CC=C(C=C2)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)C(=N)N

InChI

InChI=1S/C22H21N5O2/c1-13-12-25-22(26-13)27-18-7-4-14(5-8-18)21(28)29-19-9-6-15-10-17(20(23)24)3-2-16(15)11-19/h2-11,13H,12H2,1H3,(H3,23,24)(H2,25,26,27)