O3-[2-[[3-(diethylamino)-2-oxidanyl-propyl]carbamoyl]-1-phenyl-indol-3-yl] O1-methyl propanedioate

Systemtic Name: O3-[2-[[3-(diethylamino)-2-oxidanyl-propyl]carbamoyl]-1-phenyl-indol-3-yl] O1-methyl propanedioate Openeye Name: O3-[2-[[3-(diethylamino)-2-hydroxy-propyl]carbamoyl]-1-phenyl-indol-3-yl] O1-methyl propanedioate CAS Name: propanedioic acid O3-[2-[[[3-(diethylamino)-2-hydroxypropyl]amino]-oxomethyl]-1-phenyl-3-indolyl] ester O1-methyl ester IUPAC Name: 3-O-[2-[[3-(diethylamino)-2-hydroxypropyl]carbamoyl]-1-phenylindol-3-yl] 1-O-methyl propanedioate Traditional Name: malonic acid O3-[2-[[3-(diethylamino)-2-hydroxy-propyl]carbamoyl]-1-phenyl-indol-3-yl] ester O1-methyl ester Formula: C26H31N3O6 MolecularWeight: 481.54084

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3)OC(=O)CC(=O)OC)O

Isomeric SMILES

CCN(CC)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=CC=C3)OC(=O)CC(=O)OC)O

InChI

InChI=1S/C26H31N3O6/c1-4-28(5-2)17-19(30)16-27-26(33)24-25(35-23(32)15-22(31)34-3)20-13-9-10-14-21(20)29(24)18-11-7-6-8-12-18/h6-14,19,30H,4-5,15-17H2,1-3H3,(H,27,33)