N-(1-cyclohexyl-3,3-dideuterio-2-methyl-prop-2-enyl)-N-deuteriooxy-4-nitro-aniline

Systemtic Name: N-(1-cyclohexyl-3,3-dideuterio-2-methyl-prop-2-enyl)-N-deuteriooxy-4-nitro-aniline Openeye Name: N-(1-cyclohexyl-3,3-dideuterio-2-methyl-allyl)-N-deuteriooxy-4-nitro-aniline CAS Name: N-(1-cyclohexyl-3,3-dideuterio-2-methylprop-2-enyl)-N-deuteriooxy-4-nitroaniline IUPAC Name: N-(1-cyclohexyl-3,3-dideuterio-2-methylprop-2-enyl)-N-deuteriooxy-4-nitroaniline Traditional Name: (1-cyclohexyl-3,3-dideuterio-2-methyl-allyl)-deuteriooxy-(4-nitrophenyl)amine Formula: C16H22N2O3 MolecularWeight: 293.375965

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C1CCCCC1)N(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

[2H]C(=C(C)C(C1CCCCC1)N(C2=CC=C(C=C2)[N+](=O)[O-])O[2H])[2H]

InChI

InChI=1S/C16H22N2O3/c1-12(2)16(13-6-4-3-5-7-13)17(19)14-8-10-15(11-9-14)18(20)21/h8-11,13,16,19H,1,3-7H2,2H3/i1D2,19D