N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide

Systemtic Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide Openeye Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]tetralin-6-sulfonamide CAS Name: N-[[4-(4-morpholin-4-iumylmethyl)phenyl]methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide IUPAC Name: N-[[4-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide Traditional Name: N-[4-(morpholin-4-ium-4-ylmethyl)benzyl]tetralin-6-sulfonamide Formula: C22H29N2O3S+ MolecularWeight: 401.54226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NCC3=CC=C(C=C3)C[NH+]4CCOCC4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NCC3=CC=C(C=C3)C[NH+]4CCOCC4

InChI

InChI=1S/C22H28N2O3S/c25-28(26,22-10-9-20-3-1-2-4-21(20)15-22)23-16-18-5-7-19(8-6-18)17-24-11-13-27-14-12-24/h5-10,15,23H,1-4,11-14,16-17H2/p+1