(2Z,5Z)-2,5-bis(5-bromanyl-1-butyl-3,3-dimethyl-indol-2-ylidene)cyclopentan-1-one

Systemtic Name: (2Z,5Z)-2,5-bis(5-bromanyl-1-butyl-3,3-dimethyl-indol-2-ylidene)cyclopentan-1-one Openeye Name: (2Z,5Z)-2,5-bis(5-bromo-1-butyl-3,3-dimethyl-indolin-2-ylidene)cyclopentanone CAS Name: (2Z,5Z)-2,5-bis(5-bromo-1-butyl-3,3-dimethyl-2-indolylidene)-1-cyclopentanone IUPAC Name: (2Z,5Z)-2,5-bis(5-bromo-1-butyl-3,3-dimethylindol-2-ylidene)cyclopentan-1-one Traditional Name: (2Z,5Z)-2,5-bis(5-bromo-1-butyl-3,3-dimethyl-indolin-2-ylidene)cyclopentanone Formula: C33H40Br2N2O MolecularWeight: 640.4915

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)Br)C(C1=C3CCC(=C4C(C5=C(N4CCCC)C=CC(=C5)Br)(C)C)C3=O)(C)C

Isomeric SMILES

CCCCN1/C(=C/2\C(=O)/C(=C/3\N(C4=C(C3(C)C)C=C(C=C4)Br)CCCC)/CC2)/C(C5=C1C=CC(=C5)Br)(C)C

InChI

InChI=1S/C33H40Br2N2O/c1-7-9-17-36-27-15-11-21(34)19-25(27)32(3,4)30(36)23-13-14-24(29(23)38)31-33(5,6)26-20-22(35)12-16-28(26)37(31)18-10-8-2/h11-12,15-16,19-20H,7-10,13-14,17-18H2,1-6H3/b30-23-,31-24-