2-[4-[(2,4-dichlorophenyl)-ethanoyl-amino]-4-methoxycarbonyl-piperidin-1-yl]propanoic acid

Systemtic Name: 2-[4-[(2,4-dichlorophenyl)-ethanoyl-amino]-4-methoxycarbonyl-piperidin-1-yl]propanoic acid Openeye Name: 2-[4-(N-acetyl-2,4-dichloro-anilino)-4-methoxycarbonyl-1-piperidyl]propanoic acid CAS Name: 2-[4-(N-acetyl-2,4-dichloroanilino)-4-methoxycarbonyl-1-piperidinyl]propanoic acid IUPAC Name: 2-[4-(N-acetyl-2,4-dichloroanilino)-4-methoxycarbonylpiperidin-1-yl]propanoic acid Traditional Name: 2-[4-(N-acetyl-2,4-dichloro-anilino)-4-carbomethoxy-piperidino]propionic acid Formula: C18H22Cl2N2O5 MolecularWeight: 417.28368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N1CCC(CC1)(C(=O)OC)N(C2=C(C=C(C=C2)Cl)Cl)C(=O)C

Isomeric SMILES

CC(C(=O)O)N1CCC(CC1)(C(=O)OC)N(C2=C(C=C(C=C2)Cl)Cl)C(=O)C

InChI

InChI=1S/C18H22Cl2N2O5/c1-11(16(24)25)21-8-6-18(7-9-21,17(26)27-3)22(12(2)23)15-5-4-13(19)10-14(15)20/h4-5,10-11H,6-9H2,1-3H3,(H,24,25)