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

Systemtic Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4-methoxynaphthalen-2-yl)sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]propanoic acid Openeye Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4-methoxy-2-naphthyl)sulfonylamino]-2-oxo-pyrrolidin-1-yl]propanoic acid CAS Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4-methoxy-2-naphthalenyl)sulfonylamino]-2-oxo-1-pyrrolidinyl]propanoic acid IUPAC Name: 3-(4-carbamimidoylphenyl)-2-[3-[(4-methoxynaphthalen-2-yl)sulfonylamino]-2-oxopyrrolidin-1-yl]propanoic acid Traditional Name: 3-(4-amidinophenyl)-2-[2-keto-3-[(4-methoxy-2-naphthyl)sulfonylamino]pyrrolidino]propionic acid Formula: C25H26N4O6S MolecularWeight: 510.56214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=CC=CC=C21)S(=O)(=O)NC3CCN(C3=O)C(CC4=CC=C(C=C4)C(=N)N)C(=O)O

Isomeric SMILES

COC1=CC(=CC2=CC=CC=C21)S(=O)(=O)NC3CCN(C3=O)C(CC4=CC=C(C=C4)C(=N)N)C(=O)O

InChI

InChI=1S/C25H26N4O6S/c1-35-22-14-18(13-17-4-2-3-5-19(17)22)36(33,34)28-20-10-11-29(24(20)30)21(25(31)32)12-15-6-8-16(9-7-15)23(26)27/h2-9,13-14,20-21,28H,10-12H2,1H3,(H3,26,27)(H,31,32)