1-(4-methoxyphenyl)-2-methyl-3-nitro-7-(piperidin-1-ylmethyl)indol-6-ol hydrochloride

Systemtic Name: 1-(4-methoxyphenyl)-2-methyl-3-nitro-7-(piperidin-1-ylmethyl)indol-6-ol hydrochloride Openeye Name: 1-(4-methoxyphenyl)-2-methyl-3-nitro-7-(1-piperidylmethyl)indol-6-ol hydrochloride CAS Name: 1-(4-methoxyphenyl)-2-methyl-3-nitro-7-(1-piperidinylmethyl)-6-indolol hydrochloride IUPAC Name: 1-(4-methoxyphenyl)-2-methyl-3-nitro-7-(piperidin-1-ylmethyl)indol-6-ol hydrochloride Traditional Name: 1-(4-methoxyphenyl)-2-methyl-3-nitro-7-(piperidinomethyl)indol-6-ol hydrochloride Formula: C22H26ClN3O4 MolecularWeight: 431.91254

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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)CN4CCCCC4)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=C(C2=C(N1C3=CC=C(C=C3)OC)C(=C(C=C2)O)CN4CCCCC4)[N+](=O)[O-].Cl

InChI

InChI=1S/C22H25N3O4.ClH/c1-15-21(25(27)28)18-10-11-20(26)19(14-23-12-4-3-5-13-23)22(18)24(15)16-6-8-17(29-2)9-7-16;/h6-11,26H,3-5,12-14H2,1-2H3;1H