N-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl]ethanamide

Systemtic Name: N-[3-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl]ethanamide Openeye Name: N-[3-[4-[3-(1-piperidyl)propoxy]benzoyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]acetamide CAS Name: N-[3-[oxo-[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]acetamide IUPAC Name: N-[3-[4-(3-piperidin-1-ylpropoxy)benzoyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]acetamide Traditional Name: N-[3-[4-(3-piperidinopropoxy)benzoyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]acetamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(CCN(CC2)C(=O)C3=CC=C(C=C3)OCCCN4CCCCC4)C=C1

Isomeric SMILES

CC(=O)NC1=CC2=C(CCN(CC2)C(=O)C3=CC=C(C=C3)OCCCN4CCCCC4)C=C1

InChI

InChI=1S/C27H35N3O3/c1-21(31)28-25-9-6-22-12-17-30(18-13-24(22)20-25)27(32)23-7-10-26(11-8-23)33-19-5-16-29-14-3-2-4-15-29/h6-11,20H,2-5,12-19H2,1H3,(H,28,31)