methyl 4-[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate

Systemtic Name: methyl 4-[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxidanylidene-ethoxy]-3-nitro-benzoate Openeye Name: methyl 4-[2-[methyl-[(1S)-tetralin-1-yl]amino]-2-oxo-ethoxy]-3-nitro-benzoate CAS Name: 4-[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxoethoxy]-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-[2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]-2-oxoethoxy]-3-nitrobenzoate Traditional Name: 4-[2-keto-2-[methyl-[(1S)-tetralin-1-yl]amino]ethoxy]-3-nitro-benzoic acid methyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC2=CC=CC=C12)C(=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN([C@H]1CCCC2=CC=CC=C12)C(=O)COC3=C(C=C(C=C3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O6/c1-22(17-9-5-7-14-6-3-4-8-16(14)17)20(24)13-29-19-11-10-15(21(25)28-2)12-18(19)23(26)27/h3-4,6,8,10-12,17H,5,7,9,13H2,1-2H3/t17-/m0/s1