[(3S)-3-(2-methoxyphenyl)carbonylpiperidin-1-yl]-(1-propan-2-ylpiperidin-1-ium-4-yl)methanone

Systemtic Name: [(3S)-3-(2-methoxyphenyl)carbonylpiperidin-1-yl]-(1-propan-2-ylpiperidin-1-ium-4-yl)methanone Openeye Name: (1-isopropylpiperidin-1-ium-4-yl)-[(3S)-3-(2-methoxybenzoyl)-1-piperidyl]methanone CAS Name: [(3S)-3-[(2-methoxyphenyl)-oxomethyl]-1-piperidinyl]-(1-propan-2-yl-4-piperidin-1-iumyl)methanone IUPAC Name: [(3S)-3-(2-methoxybenzoyl)piperidin-1-yl]-(1-propan-2-ylpiperidin-1-ium-4-yl)methanone Traditional Name: (1-isopropylpiperidin-1-ium-4-yl)-[(3S)-3-o-anisoylpiperidino]methanone Formula: C22H33N2O3+ MolecularWeight: 373.50902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)C(=O)N2CCCC(C2)C(=O)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)C(=O)N2CCC[C@@H](C2)C(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C22H32N2O3/c1-16(2)23-13-10-17(11-14-23)22(26)24-12-6-7-18(15-24)21(25)19-8-4-5-9-20(19)27-3/h4-5,8-9,16-18H,6-7,10-15H2,1-3H3/p+1/t18-/m0/s1