N-[(1R)-3-methyl-1-phenyl-butyl]-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine

Systemtic Name: N-[(1R)-3-methyl-1-phenyl-butyl]-5-morpholin-4-ylsulfonyl-pyridin-1-ium-2-amine Openeye Name: N-[(1R)-3-methyl-1-phenyl-butyl]-5-morpholinosulfonyl-pyridin-1-ium-2-amine CAS Name: N-[(1R)-3-methyl-1-phenylbutyl]-5-(4-morpholinylsulfonyl)-2-pyridin-1-iumamine IUPAC Name: N-[(1R)-3-methyl-1-phenylbutyl]-5-morpholin-4-ylsulfonylpyridin-1-ium-2-amine Traditional Name: [(1R)-3-methyl-1-phenyl-butyl]-(5-morpholinosulfonylpyridin-1-ium-2-yl)amine Formula: C20H28N3O3S+ MolecularWeight: 390.51962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC=C1)NC2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)C[C@H](C1=CC=CC=C1)NC2=[NH+]C=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H27N3O3S/c1-16(2)14-19(17-6-4-3-5-7-17)22-20-9-8-18(15-21-20)27(24,25)23-10-12-26-13-11-23/h3-9,15-16,19H,10-14H2,1-2H3,(H,21,22)/p+1/t19-/m1/s1