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

Systemtic Name: [1-(4-methoxyphenyl)-2-methyl-3-nitro-6-oxidanyl-indol-7-yl]methyl-(3-oxidanylpropyl)azanium Openeye Name: [6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitro-indol-7-yl]methyl-(3-hydroxypropyl)ammonium CAS Name: [6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitro-7-indolyl]methyl-(3-hydroxypropyl)ammonium IUPAC Name: [6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitroindol-7-yl]methyl-(3-hydroxypropyl)azanium Traditional Name: [6-hydroxy-1-(4-methoxyphenyl)-2-methyl-3-nitro-indol-7-yl]methyl-(3-hydroxypropyl)ammonium Formula: C20H24N3O5+ MolecularWeight: 386.42166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C(=C(C=C2)O)C[NH2+]CCCO)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C(=C(C=C2)O)C[NH2+]CCCO)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5/c1-13-19(23(26)27)16-8-9-18(25)17(12-21-10-3-11-24)20(16)22(13)14-4-6-15(28-2)7-5-14/h4-9,21,24-25H,3,10-12H2,1-2H3/p+1