3-(4-carbamimidoylphenyl)-2-[3-[(4,6-dimethoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid

Systemtic Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4,6-dimethoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid Openeye Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4,6-dimethoxy-2-naphthyl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]propanoic acid CAS Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4,6-dimethoxy-2-naphthalenyl)sulfonylamino]-2-oxo-1-pyrrolidinyl]propanoic acid IUPAC Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4,6-dimethoxynaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]propanoic acid Traditional Name: 3-(4-amidinophenyl)-2-[3-[(4,6-dimethoxy-2-naphthyl)sulfonylamino]-2-keto-pyrrolidino]propionic acid Formula: C26H28N4O7S MolecularWeight: 540.58812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)NC3CCN(C3=O)C(CC4=CC=C(C=C4)C(=N)N)C(=O)O)OC

Isomeric SMILES

COC1=CC2=C(C=C(C=C2C=C1)S(=O)(=O)NC3CCN(C3=O)C(CC4=CC=C(C=C4)C(=N)N)C(=O)O)OC

InChI

InChI=1S/C26H28N4O7S/c1-36-18-8-7-17-12-19(14-23(37-2)20(17)13-18)38(34,35)29-21-9-10-30(25(21)31)22(26(32)33)11-15-3-5-16(6-4-15)24(27)28/h3-8,12-14,21-22,29H,9-11H2,1-2H3,(H3,27,28)(H,32,33)