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

Systemtic Name: 1-cyclopentyl-4-oxidanylidene-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]carbonyl-N-prop-2-enyl-pyridine-3-carboxamide Openeye Name: N-allyl-5-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-1-cyclopentyl-4-oxo-pyridine-3-carboxamide CAS Name: 1-cyclopentyl-4-oxo-5-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methyl]-N-prop-2-enyl-3-pyridinecarboxamide IUPAC Name: 1-cyclopentyl-4-oxo-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carbonyl]-N-prop-2-enylpyridine-3-carboxamide Traditional Name: N-allyl-5-[4-[(E)-cinnamyl]piperazin-4-ium-1-carbonyl]-1-cyclopentyl-4-keto-nicotinamide Formula: C28H35N4O3+ MolecularWeight: 475.6025

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)CC=CC3=CC=CC=C3)C4CCCC4

Isomeric SMILES

C=CCNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3)C4CCCC4

InChI

InChI=1S/C28H34N4O3/c1-2-14-29-27(34)24-20-32(23-12-6-7-13-23)21-25(26(24)33)28(35)31-18-16-30(17-19-31)15-8-11-22-9-4-3-5-10-22/h2-5,8-11,20-21,23H,1,6-7,12-19H2,(H,29,34)/p+1/b11-8+