N-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-prop-2-enyl-quinoline-8-sulfonamide

Systemtic Name: N-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-prop-2-enyl-quinoline-8-sulfonamide Openeye Name: N-allyl-N-[(3-phenyl-4,5-dihydroisoxazol-5-yl)methyl]quinoline-8-sulfonamide CAS Name: N-[(3-phenyl-4,5-dihydroisoxazol-5-yl)methyl]-N-prop-2-enyl-8-quinolinesulfonamide IUPAC Name: N-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-N-prop-2-enylquinoline-8-sulfonamide Traditional Name: N-allyl-N-[(3-phenyl-2-isoxazolin-5-yl)methyl]quinoline-8-sulfonamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1CC(=NO1)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C=CCN(CC1CC(=NO1)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H21N3O3S/c1-2-14-25(16-19-15-20(24-28-19)17-8-4-3-5-9-17)29(26,27)21-12-6-10-18-11-7-13-23-22(18)21/h2-13,19H,1,14-16H2