2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-3-methyl-6-nitro-aniline

Systemtic Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-3-methyl-6-nitro-aniline Openeye Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-3-methyl-6-nitro-aniline CAS Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-3-methyl-6-nitroaniline IUPAC Name: 2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-3-methyl-6-nitroaniline Traditional Name: [2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)-3-methyl-6-nitro-phenyl]amine Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])N)CN2CCCC3C2CCCC3

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])N)CN2CCCC3C2CCCC3

InChI

InChI=1S/C17H25N3O2/c1-12-8-9-16(20(21)22)17(18)14(12)11-19-10-4-6-13-5-2-3-7-15(13)19/h8-9,13,15H,2-7,10-11,18H2,1H3