N,N-diethyl-3-[(7Z)-3-phenyl-7-(phenylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]propan-1-amine

Systemtic Name: N,N-diethyl-3-[(7Z)-3-phenyl-7-(phenylmethylidene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]propan-1-amine Openeye Name: 3-[(7Z)-7-benzylidene-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N-diethyl-propan-1-amine CAS Name: N,N-diethyl-3-[(7Z)-3-phenyl-7-(phenylmethylene)-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-1-propanamine IUPAC Name: 3-[(7Z)-7-benzylidene-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]-N,N-diethylpropan-1-amine Traditional Name: 3-[(7Z)-7-benzal-3-phenyl-3a,4,5,6-tetrahydro-3H-indazol-2-yl]propyl-diethyl-amine Formula: C27H35N3 MolecularWeight: 401.5869

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN1C(C2CCCC(=CC3=CC=CC=C3)C2=N1)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCCN1C(C2CCC/C(=C/C3=CC=CC=C3)/C2=N1)C4=CC=CC=C4

InChI

InChI=1S/C27H35N3/c1-3-29(4-2)19-12-20-30-27(23-15-9-6-10-16-23)25-18-11-17-24(26(25)28-30)21-22-13-7-5-8-14-22/h5-10,13-16,21,25,27H,3-4,11-12,17-20H2,1-2H3/b24-21-