1-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one

Systemtic Name: 1-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-3-[4-(phenylmethyl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4-benzylpiperazin-1-yl)-1-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)propan-1-one CAS Name: 1-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-3-[4-(phenylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-benzylpiperazin-1-yl)-1-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)propan-1-one Traditional Name: 3-(4-benzylpiperazino)-1-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)propan-1-one Formula: C25H33N3O MolecularWeight: 391.54902

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(CC1)C=C(C=C2)C(=O)CCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1CCC2=C(CC1)C=C(C=C2)C(=O)CCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O/c1-26-12-9-22-7-8-24(19-23(22)10-13-26)25(29)11-14-27-15-17-28(18-16-27)20-21-5-3-2-4-6-21/h2-8,19H,9-18,20H2,1H3