(1Z,3Z)-1,3-bis(1-butyl-3,3-dimethyl-indol-2-ylidene)propan-2-one

Systemtic Name: (1Z,3Z)-1,3-bis(1-butyl-3,3-dimethyl-indol-2-ylidene)propan-2-one Openeye Name: (1Z,3Z)-1,3-bis(1-butyl-3,3-dimethyl-indolin-2-ylidene)propan-2-one CAS Name: (1Z,3Z)-1,3-bis(1-butyl-3,3-dimethyl-2-indolylidene)-2-propanone IUPAC Name: (1Z,3Z)-1,3-bis(1-butyl-3,3-dimethylindol-2-ylidene)propan-2-one Traditional Name: (1Z,3Z)-1,3-bis(1-butyl-3,3-dimethyl-indolin-2-ylidene)acetone Formula: C31H40N2O MolecularWeight: 456.6621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C(C1=CC(=O)C=C3C(C4=CC=CC=C4N3CCCC)(C)C)(C)C

Isomeric SMILES

CCCCN1/C(=C\C(=O)/C=C/2\N(C3=CC=CC=C3C2(C)C)CCCC)/C(C4=CC=CC=C14)(C)C

InChI

InChI=1S/C31H40N2O/c1-7-9-19-32-26-17-13-11-15-24(26)30(3,4)28(32)21-23(34)22-29-31(5,6)25-16-12-14-18-27(25)33(29)20-10-8-2/h11-18,21-22H,7-10,19-20H2,1-6H3/b28-21-,29-22-