2-[(5-methoxynaphthalen-1-yl)sulfonylamino]-3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]propanoic acid

Systemtic Name: 2-[(5-methoxynaphthalen-1-yl)sulfonylamino]-3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]propanoic acid Openeye Name: 2-[(5-methoxy-1-naphthyl)sulfonylamino]-3-[3-[3-(4-piperidyl)propanoylamino]propanoylamino]propanoic acid CAS Name: 2-[(5-methoxy-1-naphthalenyl)sulfonylamino]-3-[[1-oxo-3-[[1-oxo-3-(4-piperidinyl)propyl]amino]propyl]amino]propanoic acid IUPAC Name: 2-[(5-methoxynaphthalen-1-yl)sulfonylamino]-3-[3-(3-piperidin-4-ylpropanoylamino)propanoylamino]propanoic acid Traditional Name: 2-[(5-methoxy-1-naphthyl)sulfonylamino]-3-[3-[3-(4-piperidyl)propanoylamino]propanoylamino]propionic acid Formula: C25H34N4O7S MolecularWeight: 534.62506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CNC(=O)CCNC(=O)CCC3CCNCC3)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CNC(=O)CCNC(=O)CCC3CCNCC3)C(=O)O

InChI

InChI=1S/C25H34N4O7S/c1-36-21-6-2-5-19-18(21)4-3-7-22(19)37(34,35)29-20(25(32)33)16-28-24(31)12-15-27-23(30)9-8-17-10-13-26-14-11-17/h2-7,17,20,26,29H,8-16H2,1H3,(H,27,30)(H,28,31)(H,32,33)