ethyl-[(3S)-1-(3-methylthiophen-2-yl)carbonylpiperidin-3-yl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: ethyl-[(3S)-1-(3-methylthiophen-2-yl)carbonylpiperidin-3-yl]-(pyridin-4-ylmethyl)azanium Openeye Name: ethyl-[(3S)-1-(3-methylthiophene-2-carbonyl)-3-piperidyl]-(4-pyridylmethyl)ammonium CAS Name: ethyl-[(3S)-1-[(3-methyl-2-thiophenyl)-oxomethyl]-3-piperidinyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: ethyl-[(3S)-1-(3-methylthiophene-2-carbonyl)piperidin-3-yl]-(pyridin-4-ylmethyl)azanium Traditional Name: ethyl-[(3S)-1-(3-methylthiophene-2-carbonyl)-3-piperidyl]-(4-pyridylmethyl)ammonium Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=NC=C1)C2CCCN(C2)C(=O)C3=C(C=CS3)C

Isomeric SMILES

CC[NH+](CC1=CC=NC=C1)[C@H]2CCCN(C2)C(=O)C3=C(C=CS3)C

InChI

InChI=1S/C19H25N3OS/c1-3-21(13-16-6-9-20-10-7-16)17-5-4-11-22(14-17)19(23)18-15(2)8-12-24-18/h6-10,12,17H,3-5,11,13-14H2,1-2H3/p+1/t17-/m0/s1