methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-4-oxidanylidene-2-(4-phenoxyphenyl)chromene-8-carboxamide

Systemtic Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-4-oxidanylidene-2-(4-phenoxyphenyl)chromene-8-carboxamide Openeye Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-4-oxo-2-(4-phenoxyphenyl)chromene-8-carboxamide CAS Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-3-methyl-4-oxo-2-(4-phenoxyphenyl)-1-benzopyran-8-carboxamide IUPAC Name: methanesulfonic acid; N-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-3-methyl-4-oxo-2-(4-phenoxyphenyl)chromene-8-carboxamide Traditional Name: 4-keto-N-[3-[4-(2-methoxyphenyl)piperazino]propyl]-3-methyl-2-(4-phenoxyphenyl)chromene-8-carboxamide; mesylic acid Formula: C38H41N3O8S MolecularWeight: 699.81244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4OC)C5=CC=C(C=C5)OC6=CC=CC=C6.CS(=O)(=O)O

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC=C2C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4OC)C5=CC=C(C=C5)OC6=CC=CC=C6.CS(=O)(=O)O

InChI

InChI=1S/C37H37N3O5.CH4O3S/c1-26-34(41)30-12-8-13-31(36(30)45-35(26)27-16-18-29(19-17-27)44-28-10-4-3-5-11-28)37(42)38-20-9-21-39-22-24-40(25-23-39)32-14-6-7-15-33(32)43-2;1-5(2,3)4/h3-8,10-19H,9,20-25H2,1-2H3,(H,38,42);1H3,(H,2,3,4)