3-[1-[(3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]piperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one

Systemtic Name: 3-[1-[(3,5-dimethyl-1H-pyrrol-2-yl)carbonyl]piperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Openeye Name: 3-[1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-piperidyl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one CAS Name: 3-[1-[(3,5-dimethyl-1H-pyrrol-2-yl)-oxomethyl]-4-piperidinyl]-1-(4-ethyl-1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-[1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)piperidin-4-yl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Traditional Name: 3-[1-(3,5-dimethyl-1H-pyrrole-2-carbonyl)-4-piperidyl]-1-(4-ethylpiperazin-4-ium-1-yl)propan-1-one Formula: C21H35N4O2+ MolecularWeight: 375.5282

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)C3=C(C=C(N3)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)CCC2CCN(CC2)C(=O)C3=C(C=C(N3)C)C

InChI

InChI=1S/C21H34N4O2/c1-4-23-11-13-24(14-12-23)19(26)6-5-18-7-9-25(10-8-18)21(27)20-16(2)15-17(3)22-20/h15,18,22H,4-14H2,1-3H3/p+1