2-[2-butyl-2,3-bis(4-fluorophenyl)piperazin-1-yl]-5,6-dimethoxy-3-propyl-3H-1,2-benzoxazole

Systemtic Name: 2-[2-butyl-2,3-bis(4-fluorophenyl)piperazin-1-yl]-5,6-dimethoxy-3-propyl-3H-1,2-benzoxazole Openeye Name: 2-[2-butyl-2,3-bis(4-fluorophenyl)piperazin-1-yl]-5,6-dimethoxy-3-propyl-3H-1,2-benzoxazole CAS Name: 2-[2-butyl-2,3-bis(4-fluorophenyl)-1-piperazinyl]-5,6-dimethoxy-3-propyl-3H-1,2-benzoxazole IUPAC Name: 2-[2-butyl-2,3-bis(4-fluorophenyl)piperazin-1-yl]-5,6-dimethoxy-3-propyl-3H-1,2-benzoxazole Traditional Name: 2-[2-butyl-2,3-bis(4-fluorophenyl)piperazino]-5,6-dimethoxy-3-propyl-3H-indoxazene Formula: C32H39F2N3O3 MolecularWeight: 551.667166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(NCCN1N2C(C3=CC(=C(C=C3O2)OC)OC)CCC)C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

CCCCC1(C(NCCN1N2C(C3=CC(=C(C=C3O2)OC)OC)CCC)C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C32H39F2N3O3/c1-5-7-17-32(23-11-15-25(34)16-12-23)31(22-9-13-24(33)14-10-22)35-18-19-36(32)37-27(8-6-2)26-20-29(38-3)30(39-4)21-28(26)40-37/h9-16,20-21,27,31,35H,5-8,17-19H2,1-4H3