3-[7-(3-aminophenyl)-4-oxidanylidene-spiro[3H-chromene-2,1'-cyclohexane]-3-yl]propanenitrile

Systemtic Name: 3-[7-(3-aminophenyl)-4-oxidanylidene-spiro[3H-chromene-2,1'-cyclohexane]-3-yl]propanenitrile Openeye Name: 3-[7-(3-aminophenyl)-4-oxo-spiro[chromane-2,1'-cyclohexane]-3-yl]propanenitrile CAS Name: 3-[7-(3-aminophenyl)-4-oxo-3-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclohexane]yl]propanenitrile IUPAC Name: 3-[7-(3-aminophenyl)-4-oxospiro[3H-chromene-2,1'-cyclohexane]-3-yl]propanenitrile Traditional Name: 3-[7-(3-aminophenyl)-4-keto-spiro[chroman-2,1'-cyclohexane]-3-yl]propionitrile Formula: C23H24N2O2 MolecularWeight: 360.44886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)C(C(=O)C3=C(O2)C=C(C=C3)C4=CC(=CC=C4)N)CCC#N

Isomeric SMILES

C1CCC2(CC1)C(C(=O)C3=C(O2)C=C(C=C3)C4=CC(=CC=C4)N)CCC#N

InChI

InChI=1S/C23H24N2O2/c24-13-5-8-20-22(26)19-10-9-17(16-6-4-7-18(25)14-16)15-21(19)27-23(20)11-2-1-3-12-23/h4,6-7,9-10,14-15,20H,1-3,5,8,11-12,25H2