2-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-4-bromanyl-phenol

Systemtic Name: 2-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-4-bromanyl-phenol Openeye Name: 2-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-4-bromo-phenol CAS Name: 2-[8-(1-azepanylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-4-bromophenol IUPAC Name: 2-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-4-bromophenol Traditional Name: 2-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-4-bromo-phenol Formula: C24H27BrN2O3S MolecularWeight: 503.45178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=C(C=CC(=C5)Br)O

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(C4C3C=CC4)C5=C(C=CC(=C5)Br)O

InChI

InChI=1S/C24H27BrN2O3S/c25-16-8-11-23(28)21(14-16)24-19-7-5-6-18(19)20-15-17(9-10-22(20)26-24)31(29,30)27-12-3-1-2-4-13-27/h5-6,8-11,14-15,18-19,24,26,28H,1-4,7,12-13H2