2-methoxyethyl (E)-2-cyano-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enoate

Systemtic Name: 2-methoxyethyl (E)-2-cyano-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enoate Openeye Name: 2-methoxyethyl (E)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(3-nitro-4-propan-2-ylphenyl)-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-2-cyano-3-(3-nitro-4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)acrylic acid 2-methoxyethyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C(C#N)C(=O)OCCOC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C(\C#N)/C(=O)OCCOC)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O5/c1-11(2)14-5-4-12(9-15(14)18(20)21)8-13(10-17)16(19)23-7-6-22-3/h4-5,8-9,11H,6-7H2,1-3H3/b13-8+