(E)-3-[9-ethyl-2-(4-fluorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepin-1-yl]prop-2-enal

Systemtic Name: (E)-3-[9-ethyl-2-(4-fluorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepin-1-yl]prop-2-enal Openeye Name: (E)-3-[9-ethyl-2-(4-fluorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepin-1-yl]prop-2-enal CAS Name: (E)-3-[9-ethyl-2-(4-fluorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepin-1-yl]-2-propenal IUPAC Name: (E)-3-[9-ethyl-2-(4-fluorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-pyrrolo[1,2-a]azepin-1-yl]prop-2-enal Traditional Name: (E)-3-[9-ethyl-2-(4-fluorophenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-pyrrol[1,2-a]azepin-1-yl]acrolein Formula: C26H26FNO MolecularWeight: 387.489143

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN2C1=C(C(=C2C3=CC=CC=C3)C4=CC=C(C=C4)F)C=CC=O

Isomeric SMILES

CCC1CCCCN2C1=C(C(=C2C3=CC=CC=C3)C4=CC=C(C=C4)F)/C=C/C=O

InChI

InChI=1S/C26H26FNO/c1-2-19-9-6-7-17-28-25(19)23(12-8-18-29)24(20-13-15-22(27)16-14-20)26(28)21-10-4-3-5-11-21/h3-5,8,10-16,18-19H,2,6-7,9,17H2,1H3/b12-8+