anthracen-9-yl-[6,6-dimethyl-3-(1-phenylethylamino)-4-bicyclo[3.1.1]hept-3-enyl]methanone

Systemtic Name: anthracen-9-yl-[6,6-dimethyl-3-(1-phenylethylamino)-4-bicyclo[3.1.1]hept-3-enyl]methanone Openeye Name: 9-anthryl-[6,6-dimethyl-3-(1-phenylethylamino)-4-bicyclo[3.1.1]hept-3-enyl]methanone CAS Name: 9-anthracenyl-[6,6-dimethyl-3-(1-phenylethylamino)-4-bicyclo[3.1.1]hept-3-enyl]methanone IUPAC Name: anthracen-9-yl-[6,6-dimethyl-3-(1-phenylethylamino)-4-bicyclo[3.1.1]hept-3-enyl]methanone Traditional Name: 9-anthryl-[6,6-dimethyl-3-(1-phenylethylamino)-4-bicyclo[3.1.1]hept-3-enyl]methanone Formula: C32H31NO MolecularWeight: 445.59464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=C(C3CC(C2)C3(C)C)C(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=C(C3CC(C2)C3(C)C)C(=O)C4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C32H31NO/c1-20(21-11-5-4-6-12-21)33-28-19-24-18-27(32(24,2)3)30(28)31(34)29-25-15-9-7-13-22(25)17-23-14-8-10-16-26(23)29/h4-17,20,24,27,33H,18-19H2,1-3H3