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

Systemtic Name: 5-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-2-methoxy-phenol Openeye Name: 5-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-2-methoxy-phenol CAS Name: 5-[8-(1-azepanylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-2-methoxyphenol IUPAC Name: 5-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-2-methoxyphenol Traditional Name: 5-[8-(azepan-1-ylsulfonyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-4-yl]-2-methoxy-phenol Formula: C25H30N2O4S MolecularWeight: 454.5817

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C3CC=CC3C4=C(N2)C=CC(=C4)S(=O)(=O)N5CCCCCC5)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2C3CC=CC3C4=C(N2)C=CC(=C4)S(=O)(=O)N5CCCCCC5)O

InChI

InChI=1S/C25H30N2O4S/c1-31-24-12-9-17(15-23(24)28)25-20-8-6-7-19(20)21-16-18(10-11-22(21)26-25)32(29,30)27-13-4-2-3-5-14-27/h6-7,9-12,15-16,19-20,25-26,28H,2-5,8,13-14H2,1H3