1-[2-oxidanylidene-2-[[2-[[(1S)-1-phenylethyl]carbamoyl]phenyl]amino]ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-[[2-[[(1S)-1-phenylethyl]carbamoyl]phenyl]amino]ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-oxo-2-[2-[[(1S)-1-phenylethyl]carbamoyl]anilino]ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-oxo-2-[2-[oxo-[[(1S)-1-phenylethyl]amino]methyl]anilino]ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-2-[2-[[(1S)-1-phenylethyl]carbamoyl]anilino]ethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[2-[[(1S)-1-phenylethyl]carbamoyl]anilino]ethyl]piperidin-1-ium-4-carboxamide Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C23H28N4O3/c1-16(17-7-3-2-4-8-17)25-23(30)19-9-5-6-10-20(19)26-21(28)15-27-13-11-18(12-14-27)22(24)29/h2-10,16,18H,11-15H2,1H3,(H2,24,29)(H,25,30)(H,26,28)/p+1/t16-/m0/s1