2-[4-(2-methoxyphenyl)piperidin-1-yl]-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butan-1-one

Systemtic Name: 2-[4-(2-methoxyphenyl)piperidin-1-yl]-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butan-1-one Openeye Name: 2-[4-(2-methoxyphenyl)-1-piperidyl]-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butan-1-one CAS Name: 2-[4-(2-methoxyphenyl)-1-piperidinyl]-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1-butanone IUPAC Name: 2-[4-(2-methoxyphenyl)piperidin-1-yl]-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butan-1-one Traditional Name: 2-[4-(2-methoxyphenyl)piperidino]-1-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)butan-1-one Formula: C26H34N2O2 MolecularWeight: 406.56036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC2=C(CCNCC2)C=C1)N3CCC(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CCC(C(=O)C1=CC2=C(CCNCC2)C=C1)N3CCC(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C26H34N2O2/c1-3-24(26(29)22-9-8-19-10-14-27-15-11-21(19)18-22)28-16-12-20(13-17-28)23-6-4-5-7-25(23)30-2/h4-9,18,20,24,27H,3,10-17H2,1-2H3