N-tert-butyl-4-oxidanylidene-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbonyl-1-propan-2-yl-pyridine-3-carboxamide

Systemtic Name: N-tert-butyl-4-oxidanylidene-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbonyl-1-propan-2-yl-pyridine-3-carboxamide Openeye Name: N-tert-butyl-5-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-1-isopropyl-4-oxo-pyridine-3-carboxamide CAS Name: N-tert-butyl-4-oxo-5-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]-1-propan-2-yl-3-pyridinecarboxamide IUPAC Name: N-tert-butyl-4-oxo-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbonyl]-1-propan-2-ylpyridine-3-carboxamide Traditional Name: N-tert-butyl-5-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-1-isopropyl-4-keto-nicotinamide Formula: C27H37N4O3+ MolecularWeight: 465.60768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C(=O)C(=C1)C(=O)N2CC[NH+](CC2)CC=CC3=CC=CC=C3)C(=O)NC(C)(C)C

Isomeric SMILES

CC(C)N1C=C(C(=O)C(=C1)C(=O)N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3)C(=O)NC(C)(C)C

InChI

InChI=1S/C27H36N4O3/c1-20(2)31-18-22(25(33)28-27(3,4)5)24(32)23(19-31)26(34)30-16-14-29(15-17-30)13-9-12-21-10-7-6-8-11-21/h6-12,18-20H,13-17H2,1-5H3,(H,28,33)/p+1/b12-9+