N,N-diethyl-6,6-dimethyl-5-phenyl-bicyclo[3.1.0]hexa-1,3-dien-2-amine; (phenylmethyl)benzene

Systemtic Name: N,N-diethyl-6,6-dimethyl-5-phenyl-bicyclo[3.1.0]hexa-1,3-dien-2-amine; (phenylmethyl)benzene Openeye Name: benzylbenzene; N,N-diethyl-6,6-dimethyl-5-phenyl-bicyclo[3.1.0]hexa-1,3-dien-2-amine CAS Name: N,N-diethyl-6,6-dimethyl-5-phenyl-2-bicyclo[3.1.0]hexa-1,3-dienamine; (phenylmethyl)benzene IUPAC Name: benzylbenzene; N,N-diethyl-6,6-dimethyl-5-phenylbicyclo[3.1.0]hexa-1,3-dien-2-amine Traditional Name: benzylbenzene; (6,6-dimethyl-5-phenyl-2-bicyclo[3.1.0]hexa-1,3-dienyl)-diethyl-amine Formula: C31H35N MolecularWeight: 421.6163

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C2C(C2(C=C1)C3=CC=CC=C3)(C)C.C1=CC=C(C=C1)CC2=CC=CC=C2

Isomeric SMILES

CCN(CC)C1=C2C(C2(C=C1)C3=CC=CC=C3)(C)C.C1=CC=C(C=C1)CC2=CC=CC=C2

InChI

InChI=1S/C18H23N.C13H12/c1-5-19(6-2)15-12-13-18(16(15)17(18,3)4)14-10-8-7-9-11-14;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h7-13H,5-6H2,1-4H3;1-10H,11H2