(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Openeye Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methanone CAS Name: (1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Traditional Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)methanone Formula: C23H30N3O+ MolecularWeight: 364.5038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)N3CC[NH+](CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)N3CC[NH+](CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C23H29N3O/c1-18-17-22(19(2)26(18)21-10-11-21)23(27)25-15-13-24(14-16-25)12-6-9-20-7-4-3-5-8-20/h3-9,17,21H,10-16H2,1-2H3/p+1/b9-6+