[4-[(1S,5S)-5-(dimethylamino)-6-nitro-cyclohex-3-en-1-yl]-2-methoxy-phenyl] N-ethylcarbamate

Systemtic Name: [4-[(1S,5S)-5-(dimethylamino)-6-nitro-cyclohex-3-en-1-yl]-2-methoxy-phenyl] N-ethylcarbamate Openeye Name: [4-[(1S,5S)-5-(dimethylamino)-6-nitro-cyclohex-3-en-1-yl]-2-methoxy-phenyl] N-ethylcarbamate CAS Name: N-ethylcarbamic acid [4-[(1S,5S)-5-(dimethylamino)-6-nitro-1-cyclohex-3-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(1S,5S)-5-(dimethylamino)-6-nitrocyclohex-3-en-1-yl]-2-methoxyphenyl] N-ethylcarbamate Traditional Name: N-ethylcarbamic acid [4-[(1S,5S)-5-(dimethylamino)-6-nitro-cyclohex-3-en-1-yl]-2-methoxy-phenyl] ester Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)OC1=C(C=C(C=C1)C2CC=CC(C2[N+](=O)[O-])N(C)C)OC

Isomeric SMILES

CCNC(=O)OC1=C(C=C(C=C1)[C@@H]2CC=C[C@@H](C2[N+](=O)[O-])N(C)C)OC

InChI

InChI=1S/C18H25N3O5/c1-5-19-18(22)26-15-10-9-12(11-16(15)25-4)13-7-6-8-14(20(2)3)17(13)21(23)24/h6,8-11,13-14,17H,5,7H2,1-4H3,(H,19,22)/t13-,14-,17?/m0/s1