[4-(3H-benzo[f]chromen-2-ylcarbonylamino)phenyl]methyl-cyclohexyl-dimethyl-azanium

Systemtic Name: [4-(3H-benzo[f]chromen-2-ylcarbonylamino)phenyl]methyl-cyclohexyl-dimethyl-azanium Openeye Name: [4-(3H-benzo[f]chromene-2-carbonylamino)phenyl]methyl-cyclohexyl-dimethyl-ammonium CAS Name: [4-[[3H-benzo[f][1]benzopyran-2-yl(oxo)methyl]amino]phenyl]methyl-cyclohexyl-dimethylammonium IUPAC Name: [4-(3H-benzo[f]chromene-2-carbonylamino)phenyl]methyl-cyclohexyl-dimethylazanium Traditional Name: [4-(3H-benzo[f]chromene-2-carbonylamino)benzyl]-cyclohexyl-dimethyl-ammonium Formula: C29H33N2O2+ MolecularWeight: 441.58452

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2)C5CCCCC5

Isomeric SMILES

C[N+](C)(CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2)C5CCCCC5

InChI

InChI=1S/C29H32N2O2/c1-31(2,25-9-4-3-5-10-25)19-21-12-15-24(16-13-21)30-29(32)23-18-27-26-11-7-6-8-22(26)14-17-28(27)33-20-23/h6-8,11-18,25H,3-5,9-10,19-20H2,1-2H3/p+1