(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methanone CAS Name: (2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methanone Formula: C16H28N3O+ MolecularWeight: 278.41302

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(N(C(=C2)C)C(C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(N(C(=C2)C)C(C)C)C

InChI

InChI=1S/C16H27N3O/c1-6-17-7-9-18(10-8-17)16(20)15-11-13(4)19(12(2)3)14(15)5/h11-12H,6-10H2,1-5H3/p+1