N-methyl-N-[(1S)-1-[1-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]piperidin-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide

Systemtic Name: N-methyl-N-[(1S)-1-[1-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]piperidin-4-yl]-2-phenyl-ethyl]pyridine-2-carboxamide Openeye Name: N-methyl-N-[(1S)-1-[1-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]-4-piperidyl]-2-phenyl-ethyl]pyridine-2-carboxamide CAS Name: N-methyl-N-[(1S)-1-[1-[(2S)-2-(4-morpholin-4-iumyl)-1-oxopropyl]-4-piperidinyl]-2-phenylethyl]-2-pyridinecarboxamide IUPAC Name: N-methyl-N-[(1S)-1-[1-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]piperidin-4-yl]-2-phenylethyl]pyridine-2-carboxamide Traditional Name: N-methyl-N-[(1S)-1-[1-[(2S)-2-morpholin-4-ium-4-ylpropanoyl]-4-piperidyl]-2-phenyl-ethyl]picolinamide Formula: C27H37N4O3+ MolecularWeight: 465.60768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)C(CC2=CC=CC=C2)N(C)C(=O)C3=CC=CC=N3)[NH+]4CCOCC4

Isomeric SMILES

C[C@@H](C(=O)N1CCC(CC1)[C@H](CC2=CC=CC=C2)N(C)C(=O)C3=CC=CC=N3)[NH+]4CCOCC4

InChI

InChI=1S/C27H36N4O3/c1-21(30-16-18-34-19-17-30)26(32)31-14-11-23(12-15-31)25(20-22-8-4-3-5-9-22)29(2)27(33)24-10-6-7-13-28-24/h3-10,13,21,23,25H,11-12,14-20H2,1-2H3/p+1/t21-,25-/m0/s1