2-methyl-5-[[[3-(4-nitrophenoxy)-2-oxidanyl-cyclopentyl]amino]methyl]-1,5,6,7-tetrahydroindol-4-one

Systemtic Name: 2-methyl-5-[[[3-(4-nitrophenoxy)-2-oxidanyl-cyclopentyl]amino]methyl]-1,5,6,7-tetrahydroindol-4-one Openeye Name: 5-[[[2-hydroxy-3-(4-nitrophenoxy)cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one CAS Name: 5-[[[2-hydroxy-3-(4-nitrophenoxy)cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one IUPAC Name: 5-[[[2-hydroxy-3-(4-nitrophenoxy)cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one Traditional Name: 5-[[[2-hydroxy-3-(4-nitrophenoxy)cyclopentyl]amino]methyl]-2-methyl-1,5,6,7-tetrahydroindol-4-one Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(N1)CCC(C2=O)CNC3CCC(C3O)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5/c1-12-10-16-17(23-12)7-2-13(20(16)25)11-22-18-8-9-19(21(18)26)29-15-5-3-14(4-6-15)24(27)28/h3-6,10,13,18-19,21-23,26H,2,7-9,11H2,1H3