1-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-4-[4-(4-phenoxyphenyl)piperidin-1-yl]butan-1-one

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-4-[4-(4-phenoxyphenyl)piperidin-1-yl]butan-1-one Openeye Name: 1-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-4-[4-(4-phenoxyphenyl)-1-piperidyl]butan-1-one CAS Name: 1-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-4-[4-(4-phenoxyphenyl)-1-piperidinyl]-1-butanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-4-[4-(4-phenoxyphenyl)piperidin-1-yl]butan-1-one Traditional Name: 1-(3,4-dihydro-2H-1,5-benzoxazepin-5-yl)-4-[4-(4-phenoxyphenyl)piperidino]butan-1-one Formula: C30H34N2O3 MolecularWeight: 470.60256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2OC1)C(=O)CCCN3CCC(CC3)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(C2=CC=CC=C2OC1)C(=O)CCCN3CCC(CC3)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C30H34N2O3/c33-30(32-20-7-23-34-29-11-5-4-10-28(29)32)12-6-19-31-21-17-25(18-22-31)24-13-15-27(16-14-24)35-26-8-2-1-3-9-26/h1-5,8-11,13-16,25H,6-7,12,17-23H2