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

Systemtic Name: 4-[4-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]-3,5-dimethyl-piperazin-1-yl]benzamide Openeye Name: 4-[4-(2-isochroman-1-ylethyl)-3,5-dimethyl-piperazin-1-yl]benzamide CAS Name: 4-[4-[2-(3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-3,5-dimethyl-1-piperazinyl]benzamide IUPAC Name: 4-[4-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]-3,5-dimethylpiperazin-1-yl]benzamide Traditional Name: 4-[4-(2-isochroman-1-ylethyl)-3,5-dimethyl-piperazino]benzamide Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1CCC2C3=CC=CC=C3CCO2)C)C4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CC1CN(CC(N1CCC2C3=CC=CC=C3CCO2)C)C4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C24H31N3O2/c1-17-15-26(21-9-7-20(8-10-21)24(25)28)16-18(2)27(17)13-11-23-22-6-4-3-5-19(22)12-14-29-23/h3-10,17-18,23H,11-16H2,1-2H3,(H2,25,28)