[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [1-(cyclohexylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [1-(cyclohexylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-(cyclohexylmethyl)-4-piperidin-1-iumyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-(cyclohexylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-(cyclohexylmethyl)piperidin-1-ium-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C22H33N2O+ MolecularWeight: 341.51022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[NH+]2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

C1CCC(CC1)C[NH+]2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H32N2O/c25-22(24-15-12-19-8-4-5-9-21(19)17-24)20-10-13-23(14-11-20)16-18-6-2-1-3-7-18/h4-5,8-9,18,20H,1-3,6-7,10-17H2/p+1