4-[4-(4-phenoxyphenyl)piperidin-1-yl]-N-(2,3,4,5-tetrahydro-1-benzoxepin-2-yl)butanamide

Systemtic Name: 4-[4-(4-phenoxyphenyl)piperidin-1-yl]-N-(2,3,4,5-tetrahydro-1-benzoxepin-2-yl)butanamide Openeye Name: 4-[4-(4-phenoxyphenyl)-1-piperidyl]-N-(2,3,4,5-tetrahydro-1-benzoxepin-2-yl)butanamide CAS Name: 4-[4-(4-phenoxyphenyl)-1-piperidinyl]-N-(2,3,4,5-tetrahydro-1-benzoxepin-2-yl)butanamide IUPAC Name: 4-[4-(4-phenoxyphenyl)piperidin-1-yl]-N-(2,3,4,5-tetrahydro-1-benzoxepin-2-yl)butanamide Traditional Name: 4-[4-(4-phenoxyphenyl)piperidino]-N-(2,3,4,5-tetrahydro-1-benzoxepin-2-yl)butyramide Formula: C31H36N2O3 MolecularWeight: 484.62914

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC2=CC=CC=C2C1)NC(=O)CCCN3CCC(CC3)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CC(OC2=CC=CC=C2C1)NC(=O)CCCN3CCC(CC3)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C31H36N2O3/c34-30(32-31-14-6-9-26-8-4-5-12-29(26)36-31)13-7-21-33-22-19-25(20-23-33)24-15-17-28(18-16-24)35-27-10-2-1-3-11-27/h1-5,8,10-12,15-18,25,31H,6-7,9,13-14,19-23H2,(H,32,34)