N-[2-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]-3,5-dimethyl-piperazin-1-yl]benzenesulfonamide

Systemtic Name: N-[2-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]-3,5-dimethyl-piperazin-1-yl]benzenesulfonamide Openeye Name: N-[2-(2-isochroman-1-ylethyl)-3,5-dimethyl-piperazin-1-yl]benzenesulfonamide CAS Name: N-[2-[2-(3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-3,5-dimethyl-1-piperazinyl]benzenesulfonamide IUPAC Name: N-[2-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]-3,5-dimethylpiperazin-1-yl]benzenesulfonamide Traditional Name: N-[2-(2-isochroman-1-ylethyl)-3,5-dimethyl-piperazino]benzenesulfonamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(C(N1)C)CCC2C3=CC=CC=C3CCO2)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(C(C(N1)C)CCC2C3=CC=CC=C3CCO2)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H31N3O3S/c1-17-16-26(25-30(27,28)20-9-4-3-5-10-20)22(18(2)24-17)12-13-23-21-11-7-6-8-19(21)14-15-29-23/h3-11,17-18,22-25H,12-16H2,1-2H3