(1-methyl-3-nitro-5,6,7,8-tetrahydronaphthalen-2-yl) 3,4,5-trimethoxybenzoate

Systemtic Name: (1-methyl-3-nitro-5,6,7,8-tetrahydronaphthalen-2-yl) 3,4,5-trimethoxybenzoate Openeye Name: (5-methyl-7-nitro-tetralin-6-yl) 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid (1-methyl-3-nitro-5,6,7,8-tetrahydronaphthalen-2-yl) ester IUPAC Name: (1-methyl-3-nitro-5,6,7,8-tetrahydronaphthalen-2-yl) 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid (5-methyl-7-nitro-tetralin-6-yl) ester Formula: C21H23NO7 MolecularWeight: 401.40982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCCC2=CC(=C1OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C2CCCCC2=CC(=C1OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H23NO7/c1-12-15-8-6-5-7-13(15)9-16(22(24)25)19(12)29-21(23)14-10-17(26-2)20(28-4)18(11-14)27-3/h9-11H,5-8H2,1-4H3