2-[2-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-1-(ethylcarbamoyl)-2-methanoyl-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[2-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-1-(ethylcarbamoyl)-2-methanoyl-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[2-[4-(5-carbamimidoyl-2-pyridyl)phenyl]-1-(ethylcarbamoyl)-2-formyl-pyrrolidin-3-yl]acetic acid CAS Name: 2-[2-[4-(5-carbamimidoyl-2-pyridinyl)phenyl]-1-(ethylcarbamoyl)-2-formyl-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[2-[4-(5-carbamimidoylpyridin-2-yl)phenyl]-1-(ethylcarbamoyl)-2-formylpyrrolidin-3-yl]acetic acid Traditional Name: 2-[2-[4-(5-amidino-2-pyridyl)phenyl]-1-(ethylcarbamoyl)-2-formyl-pyrrolidin-3-yl]acetic acid Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCC(C1(C=O)C2=CC=C(C=C2)C3=NC=C(C=C3)C(=N)N)CC(=O)O

Isomeric SMILES

CCNC(=O)N1CCC(C1(C=O)C2=CC=C(C=C2)C3=NC=C(C=C3)C(=N)N)CC(=O)O

InChI

InChI=1S/C22H25N5O4/c1-2-25-21(31)27-10-9-17(11-19(29)30)22(27,13-28)16-6-3-14(4-7-16)18-8-5-15(12-26-18)20(23)24/h3-8,12-13,17H,2,9-11H2,1H3,(H3,23,24)(H,25,31)(H,29,30)