2-[[4-(4-methanoylpiperidin-1-yl)sulfonylphenyl]carbamoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-(4-methanoylpiperidin-1-yl)sulfonylphenyl]carbamoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-[(4-formyl-1-piperidyl)sulfonyl]phenyl]carbamoylamino]-3-phenyl-propanoic acid CAS Name: 2-[[[4-[(4-formyl-1-piperidinyl)sulfonyl]anilino]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-(4-formylpiperidin-1-yl)sulfonylphenyl]carbamoylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-(4-formylpiperidino)sulfonylphenyl]carbamoylamino]-3-phenyl-propionic acid Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C=O)S(=O)(=O)C2=CC=C(C=C2)NC(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CN(CCC1C=O)S(=O)(=O)C2=CC=C(C=C2)NC(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H25N3O6S/c26-15-17-10-12-25(13-11-17)32(30,31)19-8-6-18(7-9-19)23-22(29)24-20(21(27)28)14-16-4-2-1-3-5-16/h1-9,15,17,20H,10-14H2,(H,27,28)(H2,23,24,29)