[4-(2,3-dimethylphenyl)-5-(phenylcarbonyl)-1-(2-piperazin-1-ylethyl)piperidin-3-yl]-phenyl-methanone

Systemtic Name: [4-(2,3-dimethylphenyl)-5-(phenylcarbonyl)-1-(2-piperazin-1-ylethyl)piperidin-3-yl]-phenyl-methanone Openeye Name: [5-benzoyl-4-(2,3-dimethylphenyl)-1-(2-piperazin-1-ylethyl)-3-piperidyl]-phenyl-methanone CAS Name: [5-benzoyl-4-(2,3-dimethylphenyl)-1-[2-(1-piperazinyl)ethyl]-3-piperidinyl]-phenylmethanone IUPAC Name: [5-benzoyl-4-(2,3-dimethylphenyl)-1-(2-piperazin-1-ylethyl)piperidin-3-yl]-phenylmethanone Traditional Name: [5-benzoyl-4-(2,3-dimethylphenyl)-1-(2-piperazinoethyl)-3-piperidyl]-phenyl-methanone Formula: C33H39N3O2 MolecularWeight: 509.68166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1C)C2C(CN(CC2C(=O)C3=CC=CC=C3)CCN4CCNCC4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1C)C2C(CN(CC2C(=O)C3=CC=CC=C3)CCN4CCNCC4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C33H39N3O2/c1-24-10-9-15-28(25(24)2)31-29(32(37)26-11-5-3-6-12-26)22-36(21-20-35-18-16-34-17-19-35)23-30(31)33(38)27-13-7-4-8-14-27/h3-15,29-31,34H,16-23H2,1-2H3