2-[(4-fluorophenyl)methyl]-8-(3-piperidin-4-ylpropoxy)-1,3,4,5-tetrahydro-2-benzazepine

Systemtic Name: 2-[(4-fluorophenyl)methyl]-8-(3-piperidin-4-ylpropoxy)-1,3,4,5-tetrahydro-2-benzazepine Openeye Name: 2-[(4-fluorophenyl)methyl]-8-[3-(4-piperidyl)propoxy]-1,3,4,5-tetrahydro-2-benzazepine CAS Name: 2-[(4-fluorophenyl)methyl]-8-[3-(4-piperidinyl)propoxy]-1,3,4,5-tetrahydro-2-benzazepine IUPAC Name: 2-[(4-fluorophenyl)methyl]-8-(3-piperidin-4-ylpropoxy)-1,3,4,5-tetrahydro-2-benzazepine Traditional Name: 2-(4-fluorobenzyl)-8-[3-(4-piperidyl)propoxy]-1,3,4,5-tetrahydro-2-benzazepine Formula: C25H33FN2O MolecularWeight: 396.540723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CN(C1)CC3=CC=C(C=C3)F)C=C(C=C2)OCCCC4CCNCC4

Isomeric SMILES

C1CC2=C(CN(C1)CC3=CC=C(C=C3)F)C=C(C=C2)OCCCC4CCNCC4

InChI

InChI=1S/C25H33FN2O/c26-24-8-5-21(6-9-24)18-28-15-1-4-22-7-10-25(17-23(22)19-28)29-16-2-3-20-11-13-27-14-12-20/h5-10,17,20,27H,1-4,11-16,18-19H2