(4-tert-butylphenyl)methyl 3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (4-tert-butylphenyl)methyl 3-(3-nitrophenyl)prop-2-enoate Openeye Name: (4-tert-butylphenyl)methyl 3-(3-nitrophenyl)prop-2-enoate CAS Name: 3-(3-nitrophenyl)-2-propenoic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 3-(3-nitrophenyl)prop-2-enoate Traditional Name: 3-(3-nitrophenyl)acrylic acid (4-tert-butylbenzyl) ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)COC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)COC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21NO4/c1-20(2,3)17-10-7-16(8-11-17)14-25-19(22)12-9-15-5-4-6-18(13-15)21(23)24/h4-13H,14H2,1-3H3