2-[2-[(1-carbamimidoylpiperidin-4-yl)carbamoyl]-6-methoxy-pyridin-3-yl]-5-(2,2-dimethylpropylcarbamoyl)benzoic acid

Systemtic Name: 2-[2-[(1-carbamimidoylpiperidin-4-yl)carbamoyl]-6-methoxy-pyridin-3-yl]-5-(2,2-dimethylpropylcarbamoyl)benzoic acid Openeye Name: 2-[2-[(1-carbamimidoyl-4-piperidyl)carbamoyl]-6-methoxy-3-pyridyl]-5-(2,2-dimethylpropylcarbamoyl)benzoic acid CAS Name: 2-[2-[[(1-carbamimidoyl-4-piperidinyl)amino]-oxomethyl]-6-methoxy-3-pyridinyl]-5-[(2,2-dimethylpropylamino)-oxomethyl]benzoic acid IUPAC Name: 2-[2-[(1-carbamimidoylpiperidin-4-yl)carbamoyl]-6-methoxypyridin-3-yl]-5-(2,2-dimethylpropylcarbamoyl)benzoic acid Traditional Name: 2-[2-[(1-amidino-4-piperidyl)carbamoyl]-6-methoxy-3-pyridyl]-5-(neopentylcarbamoyl)benzoic acid Formula: C26H34N6O5 MolecularWeight: 510.58536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)C1=CC(=C(C=C1)C2=C(N=C(C=C2)OC)C(=O)NC3CCN(CC3)C(=N)N)C(=O)O

Isomeric SMILES

CC(C)(C)CNC(=O)C1=CC(=C(C=C1)C2=C(N=C(C=C2)OC)C(=O)NC3CCN(CC3)C(=N)N)C(=O)O

InChI

InChI=1S/C26H34N6O5/c1-26(2,3)14-29-22(33)15-5-6-17(19(13-15)24(35)36)18-7-8-20(37-4)31-21(18)23(34)30-16-9-11-32(12-10-16)25(27)28/h5-8,13,16H,9-12,14H2,1-4H3,(H3,27,28)(H,29,33)(H,30,34)(H,35,36)