(E)-4-(4-aminocarbonyl-4-piperidin-1-ium-1-yl-piperidin-1-yl)-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-(4-aminocarbonyl-4-piperidin-1-ium-1-yl-piperidin-1-yl)-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-(4-carbamoyl-4-piperidin-1-ium-1-yl-1-piperidyl)-4-oxo-but-2-enoate CAS Name: (E)-4-[4-carbamoyl-4-(1-piperidin-1-iumyl)-1-piperidinyl]-4-oxo-2-butenoate IUPAC Name: (E)-4-(4-carbamoyl-4-piperidin-1-ium-1-ylpiperidin-1-yl)-4-oxobut-2-enoate Traditional Name: (E)-4-(4-carbamoyl-4-piperidin-1-ium-1-yl-piperidino)-4-keto-but-2-enoate Formula: C15H23N3O4 MolecularWeight: 309.36082

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)C=CC(=O)[O-])C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CCN(CC2)C(=O)/C=C/C(=O)[O-])C(=O)N

InChI

InChI=1S/C15H23N3O4/c16-14(22)15(18-8-2-1-3-9-18)6-10-17(11-7-15)12(19)4-5-13(20)21/h4-5H,1-3,6-11H2,(H2,16,22)(H,20,21)/b5-4+