[2-[[3-(dimethylamino)-2-oxidanyl-propyl]carbamoyl]-1-(4-methoxyphenyl)indol-3-yl] benzoate

Systemtic Name: [2-[[3-(dimethylamino)-2-oxidanyl-propyl]carbamoyl]-1-(4-methoxyphenyl)indol-3-yl] benzoate Openeye Name: [2-[[3-(dimethylamino)-2-hydroxy-propyl]carbamoyl]-1-(4-methoxyphenyl)indol-3-yl] benzoate CAS Name: benzoic acid [2-[[[3-(dimethylamino)-2-hydroxypropyl]amino]-oxomethyl]-1-(4-methoxyphenyl)-3-indolyl] ester IUPAC Name: [2-[[3-(dimethylamino)-2-hydroxypropyl]carbamoyl]-1-(4-methoxyphenyl)indol-3-yl] benzoate Traditional Name: benzoic acid [2-[[3-(dimethylamino)-2-hydroxy-propyl]carbamoyl]-1-(4-methoxyphenyl)indol-3-yl] ester Formula: C28H29N3O5 MolecularWeight: 487.54696

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=C(C=C3)OC)OC(=O)C4=CC=CC=C4)O

Isomeric SMILES

CN(C)CC(CNC(=O)C1=C(C2=CC=CC=C2N1C3=CC=C(C=C3)OC)OC(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C28H29N3O5/c1-30(2)18-21(32)17-29-27(33)25-26(36-28(34)19-9-5-4-6-10-19)23-11-7-8-12-24(23)31(25)20-13-15-22(35-3)16-14-20/h4-16,21,32H,17-18H2,1-3H3,(H,29,33)