3-piperidin-4-yl-1-(3-pyridin-3-ylcarbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)propan-1-one

Systemtic Name: 3-piperidin-4-yl-1-(3-pyridin-3-ylcarbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)propan-1-one Openeye Name: 3-(4-piperidyl)-1-[3-(pyridine-3-carbonyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]propan-1-one CAS Name: 1-[3-[oxo(3-pyridinyl)methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-3-(4-piperidinyl)-1-propanone IUPAC Name: 3-piperidin-4-yl-1-[3-(pyridine-3-carbonyl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]propan-1-one Traditional Name: 1-(3-nicotinoyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-3-(4-piperidyl)propan-1-one Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCC(=O)C2=CC3=C(CCN(CC3)C(=O)C4=CN=CC=C4)C=C2

Isomeric SMILES

C1CNCCC1CCC(=O)C2=CC3=C(CCN(CC3)C(=O)C4=CN=CC=C4)C=C2

InChI

InChI=1S/C24H29N3O2/c28-23(6-3-18-7-12-25-13-8-18)21-5-4-19-9-14-27(15-10-20(19)16-21)24(29)22-2-1-11-26-17-22/h1-2,4-5,11,16-18,25H,3,6-10,12-15H2