methyl 4-[2-nitro-1-(1-oxidanylidene-6-propan-2-yl-7-propan-2-yloxy-3,4-dihydro-2H-naphthalen-2-yl)ethyl]benzoate

Systemtic Name: methyl 4-[2-nitro-1-(1-oxidanylidene-6-propan-2-yl-7-propan-2-yloxy-3,4-dihydro-2H-naphthalen-2-yl)ethyl]benzoate Openeye Name: methyl 4-[1-(7-isopropoxy-6-isopropyl-1-oxo-tetralin-2-yl)-2-nitro-ethyl]benzoate CAS Name: 4-[2-nitro-1-(1-oxo-6-propan-2-yl-7-propan-2-yloxy-3,4-dihydro-2H-naphthalen-2-yl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-nitro-1-(1-oxo-6-propan-2-yl-7-propan-2-yloxy-3,4-dihydro-2H-naphthalen-2-yl)ethyl]benzoate Traditional Name: 4-[1-(7-isopropoxy-6-isopropyl-1-keto-tetralin-2-yl)-2-nitro-ethyl]benzoic acid methyl ester Formula: C26H31NO6 MolecularWeight: 453.52744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C2C(=C1)CCC(C2=O)C(C[N+](=O)[O-])C3=CC=C(C=C3)C(=O)OC)OC(C)C

Isomeric SMILES

CC(C)C1=C(C=C2C(=C1)CCC(C2=O)C(C[N+](=O)[O-])C3=CC=C(C=C3)C(=O)OC)OC(C)C

InChI

InChI=1S/C26H31NO6/c1-15(2)21-12-19-10-11-20(25(28)22(19)13-24(21)33-16(3)4)23(14-27(30)31)17-6-8-18(9-7-17)26(29)32-5/h6-9,12-13,15-16,20,23H,10-11,14H2,1-5H3