N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(1R)-1-[4-(1-imidazolyl)phenyl]ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)N2C=CN=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H19N3O4S/c1-14(15-2-4-16(5-3-15)22-9-8-20-13-22)21-27(23,24)17-6-7-18-19(12-17)26-11-10-25-18/h2-9,12-14,21H,10-11H2,1H3/t14-/m1/s1