1-(7-bromanylspiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-yl)-4-(3-methylphenyl)piperazine

Systemtic Name: 1-(7-bromanylspiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-yl)-4-(3-methylphenyl)piperazine Openeye Name: 1-(7-bromospiro[1H-isobenzofuran-3,4'-cyclohexane]-1'-yl)-4-(m-tolyl)piperazine CAS Name: 1-(7-bromo-1'-spiro[1H-isobenzofuran-3,4'-cyclohexane]yl)-4-(3-methylphenyl)piperazine IUPAC Name: 1-(7-bromospiro[1H-2-benzofuran-3,4'-cyclohexane]-1'-yl)-4-(3-methylphenyl)piperazine Traditional Name: 1-(4'-bromospiro[cyclohexane-4,1'-phthalan]-1-yl)-4-(m-tolyl)piperazine Formula: C24H29BrN2O MolecularWeight: 441.40386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C3CCC4(CC3)C5=C(CO4)C(=CC=C5)Br

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C3CCC4(CC3)C5=C(CO4)C(=CC=C5)Br

InChI

InChI=1S/C24H29BrN2O/c1-18-4-2-5-20(16-18)27-14-12-26(13-15-27)19-8-10-24(11-9-19)22-6-3-7-23(25)21(22)17-28-24/h2-7,16,19H,8-15,17H2,1H3