3-(2-azanylnaphthalen-1-yl)-2-[1-(4-methoxy-3-nitro-phenyl)ethyl]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-(2-azanylnaphthalen-1-yl)-2-[1-(4-methoxy-3-nitro-phenyl)ethyl]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-(2-amino-1-naphthyl)-2-[1-(4-methoxy-3-nitro-phenyl)ethyl]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-(2-amino-1-naphthalenyl)-2-[1-(4-methoxy-3-nitrophenyl)ethyl]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-(2-aminonaphthalen-1-yl)-2-[1-(4-methoxy-3-nitrophenyl)ethyl]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-(2-amino-1-naphthyl)-2-[1-(4-methoxy-3-nitro-phenyl)ethyl]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)[N+](=O)[O-])C2=C(CC(CC2=O)(C)C)C3=C(C=CC4=CC=CC=C43)N

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)[N+](=O)[O-])C2=C(CC(CC2=O)(C)C)C3=C(C=CC4=CC=CC=C43)N

InChI

InChI=1S/C27H28N2O4/c1-16(18-10-12-24(33-4)22(13-18)29(31)32)25-20(14-27(2,3)15-23(25)30)26-19-8-6-5-7-17(19)9-11-21(26)28/h5-13,16H,14-15,28H2,1-4H3