methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-N,3-dimethyl-4-oxidanylidene-2-phenyl-chromene-8-sulfonamide

Systemtic Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-N,3-dimethyl-4-oxidanylidene-2-phenyl-chromene-8-sulfonamide Openeye Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-N,3-dimethyl-4-oxo-2-phenyl-chromene-8-sulfonamide CAS Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-N,3-dimethyl-4-oxo-2-phenyl-1-benzopyran-8-sulfonamide IUPAC Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-N,3-dimethyl-4-oxo-2-phenylchromene-8-sulfonamide Traditional Name: 4-keto-N-[3-[4-(2-methoxyphenyl)piperazino]propyl]-N,3-dimethyl-2-phenyl-chromene-8-sulfonamide; mesylic acid Formula: C32H39N3O8S2 MolecularWeight: 657.79736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2S(=O)(=O)N(C)CCCN3CCN(CC3)C4=CC=CC=C4OC)C5=CC=CC=C5.CS(=O)(=O)O

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2S(=O)(=O)N(C)CCCN3CCN(CC3)C4=CC=CC=C4OC)C5=CC=CC=C5.CS(=O)(=O)O

InChI

InChI=1S/C31H35N3O5S.CH4O3S/c1-23-29(35)25-13-9-16-28(31(25)39-30(23)24-11-5-4-6-12-24)40(36,37)32(2)17-10-18-33-19-21-34(22-20-33)26-14-7-8-15-27(26)38-3;1-5(2,3)4/h4-9,11-16H,10,17-22H2,1-3H3;1H3,(H,2,3,4)