diethyl-[[1-(4-methoxyphenyl)-2-methyl-3-nitro-6-oxidanyl-indol-7-yl]methyl]azanium

Systemtic Name: diethyl-[[1-(4-methoxyphenyl)-2-methyl-3-nitro-6-oxidanyl-indol-7-yl]methyl]azanium Openeye Name: diethyl-[[6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitro-indol-7-yl]methyl]ammonium CAS Name: diethyl-[[6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitro-7-indolyl]methyl]ammonium IUPAC Name: diethyl-[[6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitroindol-7-yl]methyl]azanium Traditional Name: diethyl-[[6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitro-indol-7-yl]methyl]ammonium Formula: C21H26N3O4+ MolecularWeight: 384.44884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1N(C(=C2[N+](=O)[O-])C)C3=CC=C(C=C3)OC)O

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC2=C1N(C(=C2[N+](=O)[O-])C)C3=CC=C(C=C3)OC)O

InChI

InChI=1S/C21H25N3O4/c1-5-22(6-2)13-18-19(25)12-11-17-20(24(26)27)14(3)23(21(17)18)15-7-9-16(28-4)10-8-15/h7-12,25H,5-6,13H2,1-4H3/p+1