N-cyclopropyl-3-[(3S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-cyclopropyl-3-[(3S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: N-cyclopropyl-3-[(3S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]piperidin-1-ium-3-yl]propanamide CAS Name: N-cyclopropyl-3-[(3S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-cyclopropyl-3-[(3S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: N-cyclopropyl-3-[(3S)-1-[4-methoxy-3-(methoxymethyl)benzyl]piperidin-1-ium-3-yl]propionamide Formula: C21H33N2O3+ MolecularWeight: 361.49832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C=CC(=C1)C[NH+]2CCCC(C2)CCC(=O)NC3CC3)OC

Isomeric SMILES

COCC1=C(C=CC(=C1)C[NH+]2CCC[C@H](C2)CCC(=O)NC3CC3)OC

InChI

InChI=1S/C21H32N2O3/c1-25-15-18-12-17(5-9-20(18)26-2)14-23-11-3-4-16(13-23)6-10-21(24)22-19-7-8-19/h5,9,12,16,19H,3-4,6-8,10-11,13-15H2,1-2H3,(H,22,24)/p+1/t16-/m0/s1