N-(1,3-benzodioxol-5-yl)-3-(2,3-dihydroindol-1-yl)-N-[1-(4-fluorophenyl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(2,3-dihydroindol-1-yl)-N-[1-(4-fluorophenyl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-N-[2-(benzylamino)-1-(4-fluorophenyl)-2-oxo-ethyl]-3-indolin-1-yl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(2,3-dihydroindol-1-yl)-N-[1-(4-fluorophenyl)-2-oxo-2-[(phenylmethyl)amino]ethyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-N-[2-(benzylamino)-1-(4-fluorophenyl)-2-oxoethyl]-3-(2,3-dihydroindol-1-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-N-[2-(benzylamino)-1-(4-fluorophenyl)-2-keto-ethyl]-3-indolin-1-yl-propionamide Formula: C33H30FN3O4 MolecularWeight: 551.607403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)CCC(=O)N(C3=CC4=C(C=C3)OCO4)C(C5=CC=C(C=C5)F)C(=O)NCC6=CC=CC=C6

Isomeric SMILES

C1CN(C2=CC=CC=C21)CCC(=O)N(C3=CC4=C(C=C3)OCO4)C(C5=CC=C(C=C5)F)C(=O)NCC6=CC=CC=C6

InChI

InChI=1S/C33H30FN3O4/c34-26-12-10-25(11-13-26)32(33(39)35-21-23-6-2-1-3-7-23)37(27-14-15-29-30(20-27)41-22-40-29)31(38)17-19-36-18-16-24-8-4-5-9-28(24)36/h1-15,20,32H,16-19,21-22H2,(H,35,39)