1-[4-(4-fluorophenyl)-3,4-dihydro-2H-1,5-benzoxazepin-5-yl]-5-methyl-2-pyrrolidin-1-yl-hept-6-en-1-ol

Systemtic Name: 1-[4-(4-fluorophenyl)-3,4-dihydro-2H-1,5-benzoxazepin-5-yl]-5-methyl-2-pyrrolidin-1-yl-hept-6-en-1-ol Openeye Name: 1-[4-(4-fluorophenyl)-3,4-dihydro-2H-1,5-benzoxazepin-5-yl]-5-methyl-2-pyrrolidin-1-yl-hept-6-en-1-ol CAS Name: 1-[4-(4-fluorophenyl)-3,4-dihydro-2H-1,5-benzoxazepin-5-yl]-5-methyl-2-(1-pyrrolidinyl)-6-hepten-1-ol IUPAC Name: 1-[4-(4-fluorophenyl)-3,4-dihydro-2H-1,5-benzoxazepin-5-yl]-5-methyl-2-pyrrolidin-1-ylhept-6-en-1-ol Traditional Name: 1-[4-(4-fluorophenyl)-3,4-dihydro-2H-1,5-benzoxazepin-5-yl]-5-methyl-2-pyrrolidino-hept-6-en-1-ol Formula: C27H35FN2O2 MolecularWeight: 438.577403

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C(N1C(CCOC2=CC=CC=C21)C3=CC=C(C=C3)F)O)N4CCCC4)C=C

Isomeric SMILES

CC(CCC(C(N1C(CCOC2=CC=CC=C21)C3=CC=C(C=C3)F)O)N4CCCC4)C=C

InChI

InChI=1S/C27H35FN2O2/c1-3-20(2)10-15-25(29-17-6-7-18-29)27(31)30-23(21-11-13-22(28)14-12-21)16-19-32-26-9-5-4-8-24(26)30/h3-5,8-9,11-14,20,23,25,27,31H,1,6-7,10,15-19H2,2H3