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

Systemtic Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-N,3-dimethyl-4-oxidanylidene-2-phenyl-chromene-8-sulfonamide Openeye Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-N,3-dimethyl-4-oxo-2-phenyl-chromene-8-sulfonamide CAS Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-N,3-dimethyl-4-oxo-2-phenyl-1-benzopyran-8-sulfonamide IUPAC Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-N,3-dimethyl-4-oxo-2-phenylchromene-8-sulfonamide Traditional Name: 4-keto-N-[3-[4-(2-methoxyphenyl)piperazino]butyl]-N,3-dimethyl-2-phenyl-chromene-8-sulfonamide; mesylic acid Formula: C33H41N3O8S2 MolecularWeight: 671.82394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2S(=O)(=O)N(C)CCC(C)N3CCN(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)CCC(C)N3CCN(CC3)C4=CC=CC=C4OC)C5=CC=CC=C5.CS(=O)(=O)O

InChI

InChI=1S/C32H37N3O5S.CH4O3S/c1-23(34-19-21-35(22-20-34)27-14-8-9-15-28(27)39-4)17-18-33(3)41(37,38)29-16-10-13-26-30(36)24(2)31(40-32(26)29)25-11-6-5-7-12-25;1-5(2,3)4/h5-16,23H,17-22H2,1-4H3;1H3,(H,2,3,4)