N-[[(1R)-3,4-dihydro-1H-isochromen-1-yl]methyl]-3-piperidin-1-ium-1-yl-propanamide

Systemtic Name: N-[[(1R)-3,4-dihydro-1H-isochromen-1-yl]methyl]-3-piperidin-1-ium-1-yl-propanamide Openeye Name: N-[[(1R)-isochroman-1-yl]methyl]-3-piperidin-1-ium-1-yl-propanamide CAS Name: N-[[(1R)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-3-(1-piperidin-1-iumyl)propanamide IUPAC Name: N-[[(1R)-3,4-dihydro-1H-isochromen-1-yl]methyl]-3-piperidin-1-ium-1-ylpropanamide Traditional Name: N-[[(1R)-isochroman-1-yl]methyl]-3-piperidin-1-ium-1-yl-propionamide Formula: C18H27N2O2+ MolecularWeight: 303.41918

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(=O)NCC2C3=CC=CC=C3CCO2

Isomeric SMILES

C1CC[NH+](CC1)CCC(=O)NC[C@H]2C3=CC=CC=C3CCO2

InChI

InChI=1S/C18H26N2O2/c21-18(8-12-20-10-4-1-5-11-20)19-14-17-16-7-3-2-6-15(16)9-13-22-17/h2-3,6-7,17H,1,4-5,8-14H2,(H,19,21)/p+1/t17-/m0/s1